MiMeDB: Showing metabocard for UDP-Glucuronic acid (MMDBc0029638)

Record Information

Version

1.0

Status

Detected and Quantified

Creation Date

2021-11-17 23:35:39 UTC

Update Date

2022-08-31 14:15:46 UTC

Metabolite ID

MMDBc0029638

Metabolite Identification

Common Name

UDP-Glucuronic acid

Description

UDP-Glucuronic acid is an intermediate in polymyxin resistance in E. coli. It is a substrate for UDP-GlcA C-4"-decarboxylase (gene name: arnA) which catalyzes the chemical reaction UDP-D-glucuronate + NAD+ -> UDP-beta-L-threo-pentapyranos-4-ulose + CO2 + NADH. In UDP-alpha-D-glucuronate biosynthesis (from UDP-glucose), UDP-glucose 6-dehydrogenase converts UDP-alpha-D-glucose to UDP-Glucuronic acid (EcoCyc compound: UDP-GLUCURONATE).

Structure

MOL 3D MOL SDF 3D SDF PDB 3D PDB SMILES InChI


  Mrv1652305122020552D          

 37 39  0  0  0  0            999 V2000
 9996.7322 9997.8355    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
 9998.5234 9997.8273    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
 9999.0311 9999.6859    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 9995.5531 9998.4495    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
 9999.7456 9999.2745    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
10000.4604 9999.6859    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
 9994.122310000.9252    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
10001.3740 9999.1619    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
10000.047910000.4013    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
10000.872910000.4013    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
10002.2856 9999.6880    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
10003.0012 9999.2765    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
10001.873110000.4055    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
10002.698110000.4055    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
10004.4284 9998.4536    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
10004.428410001.7522    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
10005.8576 9999.2765    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
10005.144010002.1626    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
10003.712810002.1626    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
10005.857610000.9272    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
 9997.6453 9999.7683    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
 9996.9779 9999.2833    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
 9997.2328 9998.4987    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
 9998.0578 9998.4987    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
 9998.3127 9999.2833    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
10004.429110000.9259    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
10003.714610000.5134    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
10003.7146 9999.6883    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
10004.4291 9999.2759    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
10005.1436 9999.6883    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
10005.143610000.5134    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
 9995.551810000.9238    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 9994.837310000.5113    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 9994.8373 9999.6862    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
 9995.5518 9999.2738    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 9996.2663 9999.6862    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
 9996.266310000.5113    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  3  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  8  1  0  0  0  0
  6  9  2  0  0  0  0
  6 10  1  0  0  0  0
  8 11  1  0  0  0  0
 11 12  1  0  0  0  0
 11 13  2  0  0  0  0
 11 14  1  0  0  0  0
 16 18  1  0  0  0  0
 16 19  2  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 26 31  1  0  0  0  0
 28 29  1  0  0  0  0
 29 30  1  0  0  0  0
 30 31  1  0  0  0  0
 32 33  1  0  0  0  0
 32 37  2  0  0  0  0
 33 34  1  0  0  0  0
 34 35  1  0  0  0  0
 35 36  1  0  0  0  0
 36 37  1  0  0  0  0
 21 22  1  0  0  0  0
 21 25  1  0  0  0  0
 26 27  1  0  0  0  0
 27 28  1  0  0  0  0
 35  4  2  0  0  0  0
 33  7  2  0  0  0  0
 23  1  1  1  0  0  0
 22 36  1  6  0  0  0
 24  2  1  1  0  0  0
 25  3  1  6  0  0  0
 28 12  1  1  0  0  0
 29 15  1  1  0  0  0
 26 16  1  6  0  0  0
 30 17  1  6  0  0  0
 31 20  1  1  0  0  0
M  END

HMDB0000935
     RDKit          3D
Uridine diphosphate glucuronic acid
 59 61  0  0  0  0  0  0  0  0999 V2000
   -7.5362    2.1446    1.9150 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5452    2.0628    1.1519 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3402    2.5800    1.5834 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6457    1.4390   -0.1648 C   0  0  1  0  0  0  0  0  0  0  0  0
   -5.4989    1.3950   -0.9039 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5174    0.6921   -0.2816 C   0  0  2  0  0  0  0  0  0  0  0  0
   -3.6782    0.1498   -1.2857 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1180    0.7223   -1.2303 P   0  0  0  0  0  5  0  0  0  0  0  0
   -1.6699    1.2740   -2.5871 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9021    1.9470   -0.0966 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0821   -0.5695   -0.8849 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2320   -0.0565    0.0453 P   0  0  0  0  0  5  0  0  0  0  0  0
   -0.1121    0.0093    1.5078 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6871    1.4926   -0.5128 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5077   -1.1046   -0.2450 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5365   -0.4676   -0.9677 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6240   -1.4779   -1.1768 C   0  0  1  0  0  0  0  0  0  0  0  0
    4.7122   -1.0334   -1.8657 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.8430   -1.1265   -1.0157 C   0  0  1  0  0  0  0  0  0  0  0  0
    5.9127    0.1072   -0.3175 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.6006    1.2304   -1.0242 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6293    2.4823   -0.4705 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9832    2.6337    0.8446 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0329    3.7536    1.4256 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.2897    1.5235    1.5358 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.2501    0.2998    0.9534 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5435   -0.6764    1.6456 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5398   -2.3509   -0.2633 C   0  0  2  0  0  0  0  0  0  0  0  0
    5.4881   -3.4097   -1.2038 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.0967   -2.0971    0.1222 C   0  0  2  0  0  0  0  0  0  0  0  0
    3.4239   -3.2798    0.4086 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9125   -0.4471    0.5791 C   0  0  2  0  0  0  0  0  0  0  0  0
   -3.9686   -1.4983    0.4933 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2861   -0.9905    0.3212 C   0  0  1  0  0  0  0  0  0  0  0  0
   -6.8145   -1.6260    1.4450 O   0  0  0  0  0  0  0  0  0  0  0  0
   -7.2597    0.0586   -0.1425 C   0  0  2  0  0  0  0  0  0  0  0  0
   -7.7372   -0.2110   -1.4240 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9137    3.3905    1.1328 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3790    2.0596   -0.7735 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8305    1.3884    0.2828 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7409    1.6379    0.8089 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9942    1.4510   -1.4367 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1127   -0.1758   -1.9500 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8970    0.3921   -0.4027 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1805   -2.3320   -1.7691 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.7315   -1.2167   -1.6916 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3154    1.1593   -2.0660 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3827    3.3858   -1.0233 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.5601    1.6309    2.5375 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.1828   -2.6766    0.5224 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.1396   -4.1107   -1.0066 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9804   -1.3258    0.9022 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9126   -3.1200    1.2466 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8773   -0.1252    1.6411 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1621   -2.0238   -0.3079 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2209   -1.7584   -0.4774 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1001   -2.2539    1.7645 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.1436    0.1038    0.5270 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3298   -1.0551   -1.7503 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  2  3  1  0
  2  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  2  0
  8 10  1  0
  8 11  1  0
 11 12  1  0
 12 13  2  0
 12 14  1  0
 12 15  1  0
 15 16  1  0
 16 17  1  0
 17 18  1  0
 18 19  1  0
 19 20  1  0
 20 21  1  0
 21 22  2  0
 22 23  1  0
 23 24  2  0
 23 25  1  0
 25 26  1  0
 26 27  2  0
 19 28  1  0
 28 29  1  0
 28 30  1  0
 30 31  1  0
  6 32  1  0
 32 33  1  0
 32 34  1  0
 34 35  1  0
 34 36  1  0
 36 37  1  0
 36  4  1  0
 30 17  1  0
 26 20  1  0
  3 38  1  0
  4 39  1  6
  6 40  1  1
 10 41  1  0
 14 42  1  0
 16 43  1  0
 16 44  1  0
 17 45  1  6
 19 46  1  6
 21 47  1  0
 22 48  1  0
 25 49  1  0
 28 50  1  1
 29 51  1  0
 30 52  1  1
 31 53  1  0
 32 54  1  1
 33 55  1  0
 34 56  1  6
 35 57  1  0
 36 58  1  1
 37 59  1  0
M  END


  Mrv1652305122020552D          

 37 39  0  0  0  0            999 V2000
 9996.7322 9997.8355    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
 9998.5234 9997.8273    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
 9999.0311 9999.6859    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 9995.5531 9998.4495    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
 9999.7456 9999.2745    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
10000.4604 9999.6859    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
 9994.122310000.9252    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
10001.3740 9999.1619    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
10000.047910000.4013    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
10000.872910000.4013    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
10002.2856 9999.6880    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
10003.0012 9999.2765    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
10001.873110000.4055    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
10002.698110000.4055    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
10004.4284 9998.4536    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
10004.428410001.7522    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
10005.8576 9999.2765    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
10005.144010002.1626    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
10003.712810002.1626    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
10005.857610000.9272    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
 9997.6453 9999.7683    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
 9996.9779 9999.2833    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
 9997.2328 9998.4987    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
 9998.0578 9998.4987    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
 9998.3127 9999.2833    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
10004.429110000.9259    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
10003.714610000.5134    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
10003.7146 9999.6883    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
10004.4291 9999.2759    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
10005.1436 9999.6883    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
10005.143610000.5134    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
 9995.551810000.9238    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 9994.837310000.5113    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 9994.8373 9999.6862    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
 9995.5518 9999.2738    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 9996.2663 9999.6862    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
 9996.266310000.5113    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  3  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  8  1  0  0  0  0
  6  9  2  0  0  0  0
  6 10  1  0  0  0  0
  8 11  1  0  0  0  0
 11 12  1  0  0  0  0
 11 13  2  0  0  0  0
 11 14  1  0  0  0  0
 16 18  1  0  0  0  0
 16 19  2  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 26 31  1  0  0  0  0
 28 29  1  0  0  0  0
 29 30  1  0  0  0  0
 30 31  1  0  0  0  0
 32 33  1  0  0  0  0
 32 37  2  0  0  0  0
 33 34  1  0  0  0  0
 34 35  1  0  0  0  0
 35 36  1  0  0  0  0
 36 37  1  0  0  0  0
 21 22  1  0  0  0  0
 21 25  1  0  0  0  0
 26 27  1  0  0  0  0
 27 28  1  0  0  0  0
 35  4  2  0  0  0  0
 33  7  2  0  0  0  0
 23  1  1  1  0  0  0
 22 36  1  6  0  0  0
 24  2  1  1  0  0  0
 25  3  1  6  0  0  0
 28 12  1  1  0  0  0
 29 15  1  1  0  0  0
 26 16  1  6  0  0  0
 30 17  1  6  0  0  0
 31 20  1  1  0  0  0
M  END
> <DATABASE_ID>
MMDBc0029638

> <DATABASE_NAME>
MIME

> <SMILES>
O[C@@H]1[C@@H](COP(O)(=O)OP(O)(=O)O[C@H]2O[C@@H]([C@@H](O)[C@H](O)[C@H]2O)C(O)=O)O[C@H]([C@@H]1O)N1C=CC(=O)NC1=O

> <INCHI_IDENTIFIER>
InChI=1S/C15H22N2O18P2/c18-5-1-2-17(15(26)16-5)12-9(22)6(19)4(32-12)3-31-36(27,28)35-37(29,30)34-14-10(23)7(20)8(21)11(33-14)13(24)25/h1-2,4,6-12,14,19-23H,3H2,(H,24,25)(H,27,28)(H,29,30)(H,16,18,26)/t4-,6-,7+,8+,9-,10-,11+,12-,14-/m1/s1

> <INCHI_KEY>
HDYANYHVCAPMJV-LXQIFKJMSA-N

> <FORMULA>
C15H22N2O18P2

> <MOLECULAR_WEIGHT>
580.2853

> <EXACT_MASS>
580.034284934

> <JCHEM_ACCEPTOR_COUNT>
15

> <JCHEM_ATOM_COUNT>
59

> <JCHEM_AVERAGE_POLARIZABILITY>
45.327918968046085

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
9

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
(2S,3S,4S,5R,6R)-6-({[({[(2R,3S,4R,5R)-5-(2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)-3,4,5-trihydroxyoxane-2-carboxylic acid

> <ALOGPS_LOGP>
-1.21

> <JCHEM_LOGP>
-4.676333540666667

> <ALOGPS_LOGS>
-1.51

> <JCHEM_MDDR_LIKE_RULE>
1

> <JCHEM_NUMBER_OF_RINGS>
3

> <JCHEM_PHYSIOLOGICAL_CHARGE>
-3

> <JCHEM_PKA>
2.9123372974564385

> <JCHEM_PKA_STRONGEST_ACIDIC>
1.716401031397627

> <JCHEM_PKA_STRONGEST_BASIC>
-3.73201272403137

> <JCHEM_POLAR_SURFACE_AREA>
308.60999999999996

> <JCHEM_REFRACTIVITY>
106.32319999999997

> <JCHEM_ROTATABLE_BOND_COUNT>
9

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
1.81e+01 g/l

> <JCHEM_TRADITIONAL_IUPAC>
udp-α-D-glucuronic acid

> <JCHEM_VEBER_RULE>
0

$$$$

HMDB0000935
     RDKit          3D
Uridine diphosphate glucuronic acid
 59 61  0  0  0  0  0  0  0  0999 V2000
   -7.5362    2.1446    1.9150 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5452    2.0628    1.1519 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3402    2.5800    1.5834 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6457    1.4390   -0.1648 C   0  0  1  0  0  0  0  0  0  0  0  0
   -5.4989    1.3950   -0.9039 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5174    0.6921   -0.2816 C   0  0  2  0  0  0  0  0  0  0  0  0
   -3.6782    0.1498   -1.2857 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1180    0.7223   -1.2303 P   0  0  0  0  0  5  0  0  0  0  0  0
   -1.6699    1.2740   -2.5871 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9021    1.9470   -0.0966 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0821   -0.5695   -0.8849 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2320   -0.0565    0.0453 P   0  0  0  0  0  5  0  0  0  0  0  0
   -0.1121    0.0093    1.5078 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6871    1.4926   -0.5128 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5077   -1.1046   -0.2450 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5365   -0.4676   -0.9677 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6240   -1.4779   -1.1768 C   0  0  1  0  0  0  0  0  0  0  0  0
    4.7122   -1.0334   -1.8657 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.8430   -1.1265   -1.0157 C   0  0  1  0  0  0  0  0  0  0  0  0
    5.9127    0.1072   -0.3175 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.6006    1.2304   -1.0242 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6293    2.4823   -0.4705 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9832    2.6337    0.8446 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0329    3.7536    1.4256 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.2897    1.5235    1.5358 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.2501    0.2998    0.9534 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5435   -0.6764    1.6456 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5398   -2.3509   -0.2633 C   0  0  2  0  0  0  0  0  0  0  0  0
    5.4881   -3.4097   -1.2038 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.0967   -2.0971    0.1222 C   0  0  2  0  0  0  0  0  0  0  0  0
    3.4239   -3.2798    0.4086 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9125   -0.4471    0.5791 C   0  0  2  0  0  0  0  0  0  0  0  0
   -3.9686   -1.4983    0.4933 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2861   -0.9905    0.3212 C   0  0  1  0  0  0  0  0  0  0  0  0
   -6.8145   -1.6260    1.4450 O   0  0  0  0  0  0  0  0  0  0  0  0
   -7.2597    0.0586   -0.1425 C   0  0  2  0  0  0  0  0  0  0  0  0
   -7.7372   -0.2110   -1.4240 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9137    3.3905    1.1328 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3790    2.0596   -0.7735 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8305    1.3884    0.2828 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7409    1.6379    0.8089 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9942    1.4510   -1.4367 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1127   -0.1758   -1.9500 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8970    0.3921   -0.4027 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1805   -2.3320   -1.7691 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.7315   -1.2167   -1.6916 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3154    1.1593   -2.0660 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3827    3.3858   -1.0233 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.5601    1.6309    2.5375 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.1828   -2.6766    0.5224 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.1396   -4.1107   -1.0066 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9804   -1.3258    0.9022 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9126   -3.1200    1.2466 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8773   -0.1252    1.6411 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1621   -2.0238   -0.3079 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2209   -1.7584   -0.4774 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1001   -2.2539    1.7645 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.1436    0.1038    0.5270 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3298   -1.0551   -1.7503 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  2  3  1  0
  2  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  2  0
  8 10  1  0
  8 11  1  0
 11 12  1  0
 12 13  2  0
 12 14  1  0
 12 15  1  0
 15 16  1  0
 16 17  1  0
 17 18  1  0
 18 19  1  0
 19 20  1  0
 20 21  1  0
 21 22  2  0
 22 23  1  0
 23 24  2  0
 23 25  1  0
 25 26  1  0
 26 27  2  0
 19 28  1  0
 28 29  1  0
 28 30  1  0
 30 31  1  0
  6 32  1  0
 32 33  1  0
 32 34  1  0
 34 35  1  0
 34 36  1  0
 36 37  1  0
 36  4  1  0
 30 17  1  0
 26 20  1  0
  3 38  1  0
  4 39  1  6
  6 40  1  1
 10 41  1  0
 14 42  1  0
 16 43  1  0
 16 44  1  0
 17 45  1  6
 19 46  1  6
 21 47  1  0
 22 48  1  0
 25 49  1  0
 28 50  1  1
 29 51  1  0
 30 52  1  1
 31 53  1  0
 32 54  1  1
 33 55  1  0
 34 56  1  6
 35 57  1  0
 36 58  1  1
 37 59  1  0
M  END

HEADER    PROTEIN                                 12-MAY-20   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   12-MAY-20         0                                  
HETATM    1  O   UNK     0    8660.5678662.626   0.000  0.00  0.00           O+0
HETATM    2  O   UNK     0    8663.9108662.611   0.000  0.00  0.00           O+0
HETATM    3  C   UNK     0    8664.8588666.080   0.000  0.00  0.00           C+0
HETATM    4  O   UNK     0    8658.3668663.772   0.000  0.00  0.00           O+0
HETATM    5  O   UNK     0    8666.1928665.312   0.000  0.00  0.00           O+0
HETATM    6  P   UNK     0    8667.5268666.080   0.000  0.00  0.00           P+0
HETATM    7  O   UNK     0    8655.6958668.394   0.000  0.00  0.00           O+0
HETATM    8  O   UNK     0    8669.2318665.102   0.000  0.00  0.00           O+0
HETATM    9  O   UNK     0    8666.7568667.416   0.000  0.00  0.00           O+0
HETATM   10  O   UNK     0    8668.2968667.416   0.000  0.00  0.00           O+0
HETATM   11  P   UNK     0    8670.9338666.084   0.000  0.00  0.00           P+0
HETATM   12  O   UNK     0    8672.2698665.316   0.000  0.00  0.00           O+0
HETATM   13  O   UNK     0    8670.1638667.424   0.000  0.00  0.00           O+0
HETATM   14  O   UNK     0    8671.7038667.424   0.000  0.00  0.00           O+0
HETATM   15  O   UNK     0    8674.9338663.780   0.000  0.00  0.00           O+0
HETATM   16  C   UNK     0    8674.9338669.937   0.000  0.00  0.00           C+0
HETATM   17  O   UNK     0    8677.6018665.316   0.000  0.00  0.00           O+0
HETATM   18  O   UNK     0    8676.2698670.704   0.000  0.00  0.00           O+0
HETATM   19  O   UNK     0    8673.5978670.704   0.000  0.00  0.00           O+0
HETATM   20  O   UNK     0    8677.6018668.397   0.000  0.00  0.00           O+0
HETATM   21  O   UNK     0    8662.2718666.234   0.000  0.00  0.00           O+0
HETATM   22  C   UNK     0    8661.0258665.329   0.000  0.00  0.00           C+0
HETATM   23  C   UNK     0    8661.5018663.864   0.000  0.00  0.00           C+0
HETATM   24  C   UNK     0    8663.0418663.864   0.000  0.00  0.00           C+0
HETATM   25  C   UNK     0    8663.5178665.329   0.000  0.00  0.00           C+0
HETATM   26  C   UNK     0    8674.9348668.395   0.000  0.00  0.00           C+0
HETATM   27  O   UNK     0    8673.6018667.625   0.000  0.00  0.00           O+0
HETATM   28  C   UNK     0    8673.6018666.085   0.000  0.00  0.00           C+0
HETATM   29  C   UNK     0    8674.9348665.315   0.000  0.00  0.00           C+0
HETATM   30  C   UNK     0    8676.2688666.085   0.000  0.00  0.00           C+0
HETATM   31  C   UNK     0    8676.2688667.625   0.000  0.00  0.00           C+0
HETATM   32  C   UNK     0    8658.3638668.391   0.000  0.00  0.00           C+0
HETATM   33  C   UNK     0    8657.0308667.621   0.000  0.00  0.00           C+0
HETATM   34  N   UNK     0    8657.0308666.081   0.000  0.00  0.00           N+0
HETATM   35  C   UNK     0    8658.3638665.311   0.000  0.00  0.00           C+0
HETATM   36  N   UNK     0    8659.6978666.081   0.000  0.00  0.00           N+0
HETATM   37  C   UNK     0    8659.6978667.621   0.000  0.00  0.00           C+0
CONECT    1   23                                                            
CONECT    2   24                                                            
CONECT    3    5   25                                                       
CONECT    4   35                                                            
CONECT    5    3    6                                                       
CONECT    6    5    8    9   10                                             
CONECT    7   33                                                            
CONECT    8    6   11                                                       
CONECT    9    6                                                            
CONECT   10    6                                                            
CONECT   11    8   12   13   14                                             
CONECT   12   11   28                                                       
CONECT   13   11                                                            
CONECT   14   11                                                            
CONECT   15   29                                                            
CONECT   16   18   19   26                                                  
CONECT   17   30                                                            
CONECT   18   16                                                            
CONECT   19   16                                                            
CONECT   20   31                                                            
CONECT   21   22   25                                                       
CONECT   22   23   21   36                                                  
CONECT   23   22   24    1                                                  
CONECT   24   23   25    2                                                  
CONECT   25   24   21    3                                                  
CONECT   26   31   27   16                                                  
CONECT   27   26   28                                                       
CONECT   28   29   27   12                                                  
CONECT   29   28   30   15                                                  
CONECT   30   29   31   17                                                  
CONECT   31   26   30   20                                                  
CONECT   32   33   37                                                       
CONECT   33   32   34    7                                                  
CONECT   34   33   35                                                       
CONECT   35   34   36    4                                                  
CONECT   36   35   37   22                                                  
CONECT   37   32   36                                                       
MASTER        0    0    0    0    0    0    0    0   37    0   78    0
END

COMPND    HMDB0000935
HETATM    1  O1  UNL     1      -7.536   2.145   1.915  1.00  0.00           O  
HETATM    2  C1  UNL     1      -6.545   2.063   1.152  1.00  0.00           C  
HETATM    3  O2  UNL     1      -5.340   2.580   1.583  1.00  0.00           O  
HETATM    4  C2  UNL     1      -6.646   1.439  -0.165  1.00  0.00           C  
HETATM    5  O3  UNL     1      -5.499   1.395  -0.904  1.00  0.00           O  
HETATM    6  C3  UNL     1      -4.517   0.692  -0.282  1.00  0.00           C  
HETATM    7  O4  UNL     1      -3.678   0.150  -1.286  1.00  0.00           O  
HETATM    8  P1  UNL     1      -2.118   0.722  -1.230  1.00  0.00           P  
HETATM    9  O5  UNL     1      -1.670   1.274  -2.587  1.00  0.00           O  
HETATM   10  O6  UNL     1      -1.902   1.947  -0.097  1.00  0.00           O  
HETATM   11  O7  UNL     1      -1.082  -0.569  -0.885  1.00  0.00           O  
HETATM   12  P2  UNL     1       0.232  -0.057   0.045  1.00  0.00           P  
HETATM   13  O8  UNL     1      -0.112   0.009   1.508  1.00  0.00           O  
HETATM   14  O9  UNL     1       0.687   1.493  -0.513  1.00  0.00           O  
HETATM   15  O10 UNL     1       1.508  -1.105  -0.245  1.00  0.00           O  
HETATM   16  C4  UNL     1       2.536  -0.468  -0.968  1.00  0.00           C  
HETATM   17  C5  UNL     1       3.624  -1.478  -1.177  1.00  0.00           C  
HETATM   18  O11 UNL     1       4.712  -1.033  -1.866  1.00  0.00           O  
HETATM   19  C6  UNL     1       5.843  -1.127  -1.016  1.00  0.00           C  
HETATM   20  N1  UNL     1       5.913   0.107  -0.318  1.00  0.00           N  
HETATM   21  C7  UNL     1       5.601   1.230  -1.024  1.00  0.00           C  
HETATM   22  C8  UNL     1       5.629   2.482  -0.471  1.00  0.00           C  
HETATM   23  C9  UNL     1       5.983   2.634   0.845  1.00  0.00           C  
HETATM   24  O12 UNL     1       6.033   3.754   1.426  1.00  0.00           O  
HETATM   25  N2  UNL     1       6.290   1.523   1.536  1.00  0.00           N  
HETATM   26  C10 UNL     1       6.250   0.300   0.953  1.00  0.00           C  
HETATM   27  O13 UNL     1       6.543  -0.676   1.646  1.00  0.00           O  
HETATM   28  C11 UNL     1       5.540  -2.351  -0.263  1.00  0.00           C  
HETATM   29  O14 UNL     1       5.488  -3.410  -1.204  1.00  0.00           O  
HETATM   30  C12 UNL     1       4.097  -2.097   0.122  1.00  0.00           C  
HETATM   31  O15 UNL     1       3.424  -3.280   0.409  1.00  0.00           O  
HETATM   32  C13 UNL     1      -4.913  -0.447   0.579  1.00  0.00           C  
HETATM   33  O16 UNL     1      -3.969  -1.498   0.493  1.00  0.00           O  
HETATM   34  C14 UNL     1      -6.286  -0.991   0.321  1.00  0.00           C  
HETATM   35  O17 UNL     1      -6.815  -1.626   1.445  1.00  0.00           O  
HETATM   36  C15 UNL     1      -7.260   0.059  -0.142  1.00  0.00           C  
HETATM   37  O18 UNL     1      -7.737  -0.211  -1.424  1.00  0.00           O  
HETATM   38  H1  UNL     1      -4.914   3.390   1.133  1.00  0.00           H  
HETATM   39  H2  UNL     1      -7.379   2.060  -0.773  1.00  0.00           H  
HETATM   40  H3  UNL     1      -3.830   1.388   0.283  1.00  0.00           H  
HETATM   41  H4  UNL     1      -1.741   1.638   0.809  1.00  0.00           H  
HETATM   42  H5  UNL     1       0.994   1.451  -1.437  1.00  0.00           H  
HETATM   43  H6  UNL     1       2.113  -0.176  -1.950  1.00  0.00           H  
HETATM   44  H7  UNL     1       2.897   0.392  -0.403  1.00  0.00           H  
HETATM   45  H8  UNL     1       3.181  -2.332  -1.769  1.00  0.00           H  
HETATM   46  H9  UNL     1       6.731  -1.217  -1.692  1.00  0.00           H  
HETATM   47  H10 UNL     1       5.315   1.159  -2.066  1.00  0.00           H  
HETATM   48  H11 UNL     1       5.383   3.386  -1.023  1.00  0.00           H  
HETATM   49  H12 UNL     1       6.560   1.631   2.538  1.00  0.00           H  
HETATM   50  H13 UNL     1       6.183  -2.677   0.522  1.00  0.00           H  
HETATM   51  H14 UNL     1       6.140  -4.111  -1.007  1.00  0.00           H  
HETATM   52  H15 UNL     1       3.980  -1.326   0.902  1.00  0.00           H  
HETATM   53  H16 UNL     1       2.913  -3.120   1.247  1.00  0.00           H  
HETATM   54  H17 UNL     1      -4.877  -0.125   1.641  1.00  0.00           H  
HETATM   55  H18 UNL     1      -4.162  -2.024  -0.308  1.00  0.00           H  
HETATM   56  H19 UNL     1      -6.221  -1.758  -0.477  1.00  0.00           H  
HETATM   57  H20 UNL     1      -6.100  -2.254   1.765  1.00  0.00           H  
HETATM   58  H21 UNL     1      -8.144   0.104   0.527  1.00  0.00           H  
HETATM   59  H22 UNL     1      -7.330  -1.055  -1.750  1.00  0.00           H  
CONECT    1    2    2
CONECT    2    3    4
CONECT    3   38
CONECT    4    5   36   39
CONECT    5    6
CONECT    6    7   32   40
CONECT    7    8
CONECT    8    9    9   10   11
CONECT   10   41
CONECT   11   12
CONECT   12   13   13   14   15
CONECT   14   42
CONECT   15   16
CONECT   16   17   43   44
CONECT   17   18   30   45
CONECT   18   19
CONECT   19   20   28   46
CONECT   20   21   26
CONECT   21   22   22   47
CONECT   22   23   48
CONECT   23   24   24   25
CONECT   25   26   49
CONECT   26   27   27
CONECT   28   29   30   50
CONECT   29   51
CONECT   30   31   52
CONECT   31   53
CONECT   32   33   34   54
CONECT   33   55
CONECT   34   35   36   56
CONECT   35   57
CONECT   36   37   58
CONECT   37   59
END

HMDB0000935
     RDKit          3D
Uridine diphosphate glucuronic acid
 59 61  0  0  0  0  0  0  0  0999 V2000
   -7.5362    2.1446    1.9150 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5452    2.0628    1.1519 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3402    2.5800    1.5834 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6457    1.4390   -0.1648 C   0  0  1  0  0  0  0  0  0  0  0  0
   -5.4989    1.3950   -0.9039 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5174    0.6921   -0.2816 C   0  0  2  0  0  0  0  0  0  0  0  0
   -3.6782    0.1498   -1.2857 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1180    0.7223   -1.2303 P   0  0  0  0  0  5  0  0  0  0  0  0
   -1.6699    1.2740   -2.5871 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9021    1.9470   -0.0966 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0821   -0.5695   -0.8849 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2320   -0.0565    0.0453 P   0  0  0  0  0  5  0  0  0  0  0  0
   -0.1121    0.0093    1.5078 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6871    1.4926   -0.5128 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5077   -1.1046   -0.2450 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5365   -0.4676   -0.9677 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6240   -1.4779   -1.1768 C   0  0  1  0  0  0  0  0  0  0  0  0
    4.7122   -1.0334   -1.8657 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.8430   -1.1265   -1.0157 C   0  0  1  0  0  0  0  0  0  0  0  0
    5.9127    0.1072   -0.3175 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.6006    1.2304   -1.0242 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6293    2.4823   -0.4705 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9832    2.6337    0.8446 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0329    3.7536    1.4256 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.2897    1.5235    1.5358 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.2501    0.2998    0.9534 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5435   -0.6764    1.6456 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5398   -2.3509   -0.2633 C   0  0  2  0  0  0  0  0  0  0  0  0
    5.4881   -3.4097   -1.2038 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.0967   -2.0971    0.1222 C   0  0  2  0  0  0  0  0  0  0  0  0
    3.4239   -3.2798    0.4086 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9125   -0.4471    0.5791 C   0  0  2  0  0  0  0  0  0  0  0  0
   -3.9686   -1.4983    0.4933 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2861   -0.9905    0.3212 C   0  0  1  0  0  0  0  0  0  0  0  0
   -6.8145   -1.6260    1.4450 O   0  0  0  0  0  0  0  0  0  0  0  0
   -7.2597    0.0586   -0.1425 C   0  0  2  0  0  0  0  0  0  0  0  0
   -7.7372   -0.2110   -1.4240 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9137    3.3905    1.1328 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3790    2.0596   -0.7735 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8305    1.3884    0.2828 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7409    1.6379    0.8089 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9942    1.4510   -1.4367 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1127   -0.1758   -1.9500 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8970    0.3921   -0.4027 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1805   -2.3320   -1.7691 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.7315   -1.2167   -1.6916 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3154    1.1593   -2.0660 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3827    3.3858   -1.0233 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.5601    1.6309    2.5375 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.1828   -2.6766    0.5224 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.1396   -4.1107   -1.0066 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9804   -1.3258    0.9022 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9126   -3.1200    1.2466 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8773   -0.1252    1.6411 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1621   -2.0238   -0.3079 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2209   -1.7584   -0.4774 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1001   -2.2539    1.7645 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.1436    0.1038    0.5270 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3298   -1.0551   -1.7503 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  2  3  1  0
  2  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  2  0
  8 10  1  0
  8 11  1  0
 11 12  1  0
 12 13  2  0
 12 14  1  0
 12 15  1  0
 15 16  1  0
 16 17  1  0
 17 18  1  0
 18 19  1  0
 19 20  1  0
 20 21  1  0
 21 22  2  0
 22 23  1  0
 23 24  2  0
 23 25  1  0
 25 26  1  0
 26 27  2  0
 19 28  1  0
 28 29  1  0
 28 30  1  0
 30 31  1  0
  6 32  1  0
 32 33  1  0
 32 34  1  0
 34 35  1  0
 34 36  1  0
 36 37  1  0
 36  4  1  0
 30 17  1  0
 26 20  1  0
  3 38  1  0
  4 39  1  6
  6 40  1  1
 10 41  1  0
 14 42  1  0
 16 43  1  0
 16 44  1  0
 17 45  1  6
 19 46  1  6
 21 47  1  0
 22 48  1  0
 25 49  1  0
 28 50  1  1
 29 51  1  0
 30 52  1  1
 31 53  1  0
 32 54  1  1
 33 55  1  0
 34 56  1  6
 35 57  1  0
 36 58  1  1
 37 59  1  0
M  END

Synonyms

Value	Source
UDP-alpha-D-Glucuronate	ChEBI
UDP-D-Glucuronate	ChEBI
UDP-Glucuronate	ChEBI
UDPglucuronate	ChEBI
URIDINE-5'-diphosphATE-glucuronIC ACID	ChEBI
UDP-a-D-Glucuronate	Generator
UDP-a-D-Glucuronic acid	Generator
UDP-alpha-D-Glucuronic acid	Generator
UDP-Α-D-glucuronate	Generator
UDP-Α-D-glucuronic acid	Generator
UDP-D-Glucuronic acid	Generator
UDP-Glucuronic acid	Generator
UDPglucuronic acid	Generator
URIDINE-5'-diphosphate-glucuronate	Generator
URIDINE-5'-diphosphoric acid-glucuronic acid	Generator
Uridine diphosphate glucuronate	Generator
Uridine diphosphoric acid glucuronic acid	Generator
a-D-Glucopyranuronic acid 1->5'-ester with uridine 5'-(trihydrogen pyrophosphate)	HMDB
a-D-Glucopyranuronic acid ester with uridine 5'-pyrophosphate	HMDB
alpha-D-Glucopyranuronic acid 1-p'-ester with uridine 5'-(trihydrogen diphosphate)	HMDB
alpha-delta-Glucopyranuronic acid 1->5'-ester with uridine 5'-(trihydrogen pyrophosphate)	HMDB
alpha-delta-Glucopyranuronic acid 1-p'-ester with uridine 5'-(trihydrogen diphosphate)	HMDB
alpha-delta-Glucopyranuronic acid ester with uridine 5'-pyrophosphate	HMDB
Glucopyranuronic acid 1-ester with uridine 5'-pyrophosphate	HMDB
UDP Glucuronate	HMDB
UDP Glucuronic acid	HMDB
UDP-alpha-delta-Glucuronate	HMDB
UDP-delta-Glucuronate	HMDB
UDP-delta-Glucuronic acid	HMDB
UDP-GlcUA	HMDB
UDPGA	HMDB
UGA	HMDB
Uridine 5'-diphospho-a-D-glucuronate	HMDB
Uridine 5'-diphospho-a-D-glucuronic acid	HMDB
Uridine 5'-diphospho-alpha-delta-glucuronate	HMDB
Uridine 5'-diphospho-alpha-delta-glucuronic acid	HMDB
Uridine 5'-diphospho-glucuronic acid	HMDB
Uridine 5'-diphosphoglucuronate	HMDB
Uridine 5'-diphosphoglucuronic acid	HMDB
Uridine 5'-[3-(D-glucopyranosyloxyuronic acid) dihydrogen diphosphate]	HMDB
Uridine diphosphate-glucuronate	HMDB
Uridine diphospho-D-glucuronate	HMDB
Uridine diphospho-D-glucuronic acid	HMDB
Uridine diphospho-delta-glucuronate	HMDB
Uridine diphospho-delta-glucuronic acid	HMDB
Uridine diphosphoglucuronate	HMDB
Uridine diphosphoglucuronic acid	HMDB
Uridine pyrophosphoglucuronate	HMDB
Uridine pyrophosphoglucuronic acid	HMDB
Uridinediphosphoglucuronic acid	HMDB
Acid, UDP glucuronic	HMDB
Acid, uridine diphosphoglucuronic	HMDB
Glucuronic acid, UDP	HMDB
Diphosphoglucuronic acid, uridine	HMDB
Uridine 5'-diphospho-alpha-D-glucuronic acid	HMDB
Uridine 5'-diphospho-α-D-glucuronic acid	HMDB
Uridine 5’-diphospho-α-D-glucuronic acid	HMDB
Uridine 5’-diphosphoglucuronic acid	HMDB
Uridine diphosphate glucuronic acid	HMDB

Molecular Formula

C₁₅H₂₂N₂O₁₈P₂

Average Mass

580.2853

Monoisotopic Mass

580.034284934

IUPAC Name

(2S,3S,4S,5R,6R)-6-({[({[(2R,3S,4R,5R)-5-(2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)-3,4,5-trihydroxyoxane-2-carboxylic acid

Traditional Name

udp-α-D-glucuronic acid

CAS Registry Number

2616-64-0

SMILES

O[C@@H]1[C@@H](COP(O)(=O)OP(O)(=O)O[C@H]2O[C@@H]([C@@H](O)[C@H](O)[C@H]2O)C(O)=O)O[C@H]([C@@H]1O)N1C=CC(=O)NC1=O

InChI Identifier

InChI=1S/C15H22N2O18P2/c18-5-1-2-17(15(26)16-5)12-9(22)6(19)4(32-12)3-31-36(27,28)35-37(29,30)34-14-10(23)7(20)8(21)11(33-14)13(24)25/h1-2,4,6-12,14,19-23H,3H2,(H,24,25)(H,27,28)(H,29,30)(H,16,18,26)/t4-,6-,7+,8+,9-,10-,11+,12-,14-/m1/s1

InChI Key

HDYANYHVCAPMJV-LXQIFKJMSA-N

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as gamma butyrolactones. Gamma butyrolactones are compounds containing a gamma butyrolactone moiety, which consists of an aliphatic five-member ring with four carbon atoms, one oxygen atom, and bears a ketone group on the carbon adjacent to the oxygen atom.

Kingdom

Organic compounds

Super Class

Organoheterocyclic compounds

Class

Lactones

Sub Class

Gamma butyrolactones

Direct Parent

Gamma butyrolactones

Alternative Parents

Substituents

Gamma butyrolactone
Tetrahydrofuran
Secondary alcohol
Carboxylic acid ester
1,2-diol
Oxacycle
Monocarboxylic acid or derivatives
Carboxylic acid derivative
Organic oxygen compound
Organic oxide
Hydrocarbon derivative
Organooxygen compound
Carbonyl group
Alcohol
Aliphatic heteromonocyclic compound

Molecular Framework

Aliphatic heteromonocyclic compounds

External Descriptors

diol (CHEBI:71176 )
butan-4-olide (CHEBI:71176 )

Functional Ontology

Not Available

Physical Properties

State

Expected Solid

Predicted Properties

Property	Value	Source
Water Solubility	18.1 g/L	ALOGPS
logP	-1.2	ALOGPS
logP	-4.7	ChemAxon
logS	-1.5	ALOGPS
pKa (Strongest Acidic)	1.72	ChemAxon
pKa (Strongest Basic)	-3.7	ChemAxon
Physiological Charge	-3	ChemAxon
Hydrogen Acceptor Count	15	ChemAxon
Hydrogen Donor Count	9	ChemAxon
Polar Surface Area	308.61 Å²	ChemAxon
Rotatable Bond Count	9	ChemAxon
Refractivity	106.32 m³·mol⁻¹	ChemAxon
Polarizability	45.33 Å³	ChemAxon
Number of Rings	3	ChemAxon
Bioavailability	No	ChemAxon
Rule of Five	No	ChemAxon
Ghose Filter	No	ChemAxon
Veber's Rule	No	ChemAxon
MDDR-like Rule	Yes	ChemAxon

Spectra

Spectrum Type	Description	Splash Key	Deposition Date	View
Predicted GC-MS	Predicted GC-MS Spectrum - GC-MS (Non-derivatized) - 70eV, Positive	splash10-0w29-3322930000-0ce18416678ea80bec67	2017-09-01	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - GC-MS (1 TMS) - 70eV, Positive	splash10-004r-4862914000-b91973e084ab99d92364	2017-10-06	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - GC-MS ("Uridine diphosphate glucuronic acid,1TMS,#1" TMS) - 70eV, Positive	Not Available	2021-10-14	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - GC-MS (TMS_1_2) - 70eV, Positive	Not Available	2021-10-15	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - GC-MS (TMS_1_3) - 70eV, Positive	Not Available	2021-10-15	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - GC-MS (TMS_1_4) - 70eV, Positive	Not Available	2021-10-15	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - GC-MS (TMS_1_5) - 70eV, Positive	Not Available	2021-10-15	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - GC-MS (TMS_1_6) - 70eV, Positive	Not Available	2021-10-15	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - GC-MS (TMS_1_7) - 70eV, Positive	Not Available	2021-10-15	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - GC-MS (TMS_1_8) - 70eV, Positive	Not Available	2021-10-15	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - GC-MS (TMS_1_9) - 70eV, Positive	Not Available	2021-10-15	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - GC-MS (TMS_2_1) - 70eV, Positive	Not Available	2021-10-15	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - GC-MS (TMS_2_2) - 70eV, Positive	Not Available	2021-10-15	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - GC-MS (TMS_2_3) - 70eV, Positive	Not Available	2021-10-15	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - GC-MS (TMS_2_4) - 70eV, Positive	Not Available	2021-10-15	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - GC-MS (TMS_2_5) - 70eV, Positive	Not Available	2021-10-15	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - GC-MS (TMS_2_6) - 70eV, Positive	Not Available	2021-10-15	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - GC-MS (TMS_2_7) - 70eV, Positive	Not Available	2021-10-15	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - GC-MS (TMS_2_8) - 70eV, Positive	Not Available	2021-10-15	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - GC-MS (TMS_2_9) - 70eV, Positive	Not Available	2021-10-15	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - GC-MS (TMS_2_10) - 70eV, Positive	Not Available	2021-10-15	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - GC-MS (TMS_2_11) - 70eV, Positive	Not Available	2021-10-15	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - GC-MS (TMS_2_12) - 70eV, Positive	Not Available	2021-10-15	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - GC-MS (TMS_2_13) - 70eV, Positive	Not Available	2021-10-15	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - GC-MS (TMS_2_14) - 70eV, Positive	Not Available	2021-10-15	View Spectrum
LC-MS/MS	LC-MS/MS Spectrum - 20V, Negative	splash10-0fb9-0135690000-0ff1e6a4900ecdc6a915	2021-09-20	View Spectrum
LC-MS/MS	LC-MS/MS Spectrum - 35V, Negative	splash10-004i-0000090000-1cdeb28950f03fda28ea	2021-09-20	View Spectrum
LC-MS/MS	LC-MS/MS Spectrum - 35V, Negative	splash10-0r29-5934300000-e5fcfe66852c383b82d4	2021-09-20	View Spectrum
LC-MS/MS	LC-MS/MS Spectrum - 10V, Negative	splash10-004i-0000090000-bc00d530c5ce60dfe672	2021-09-20	View Spectrum
LC-MS/MS	LC-MS/MS Spectrum - 40V, Negative	splash10-0a4i-3922200000-353e174f91c8b182064c	2021-09-20	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 10V, Positive	splash10-03di-0901110000-d434fad6ebdd7797c473	2015-09-15	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 20V, Positive	splash10-03di-3911000000-b27e8f43f987aadd35fd	2015-09-15	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 40V, Positive	splash10-03di-4900000000-6c8ee9c73e164f9ccf76	2015-09-15	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 10V, Negative	splash10-0imu-4601190000-7a0e82462b874f18b2c4	2015-09-15	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 20V, Negative	splash10-01ox-9817020000-a72141b1bee762a83bc3	2015-09-15	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 40V, Negative	splash10-0bvl-4901000000-5d52b1b8f03063646a7f	2015-09-15	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 10V, Negative	splash10-004i-0001090000-c773521e9e340d5e6564	2021-09-22	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 20V, Negative	splash10-055e-9424840000-deea5ee6888efff36f31	2021-09-22	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 40V, Negative	splash10-0a5a-3936510000-b41af0ea55c95b9da1e1	2021-09-22	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 10V, Positive	splash10-03di-1700490000-7f9159b24d34e9358740	2021-09-22	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 20V, Positive	splash10-03di-4921760000-cd1fe2a62f343b8eb5ba	2021-09-22	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 40V, Positive	splash10-0209-6940100000-aa916ad8a0ed15e6eb2a	2021-09-22	View Spectrum
1D NMR	¹H NMR Spectrum (1D, D₂O, experimental)		2016-10-22	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, D₂O, experimental)		2016-10-22	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 100 MHz, D₂O, predicted)		2021-09-29	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 100 MHz, D₂O, predicted)		2021-09-29	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 1000 MHz, D₂O, predicted)		2021-09-29	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 1000 MHz, D₂O, predicted)		2021-09-29	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 200 MHz, D₂O, predicted)		2021-09-29	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 200 MHz, D₂O, predicted)		2021-09-29	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 300 MHz, D₂O, predicted)		2021-09-29	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 300 MHz, D₂O, predicted)		2021-09-29	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 400 MHz, D₂O, predicted)		2021-09-29	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 400 MHz, D₂O, predicted)		2021-09-29	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 500 MHz, D₂O, predicted)		2021-09-29	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 500 MHz, D₂O, predicted)		2021-09-29	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 600 MHz, D₂O, predicted)		2021-09-29	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 600 MHz, D₂O, predicted)		2021-09-29	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 700 MHz, D₂O, predicted)		2021-09-29	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 700 MHz, D₂O, predicted)		2021-09-29	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 800 MHz, D₂O, predicted)		2021-09-29	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 800 MHz, D₂O, predicted)		2021-09-29	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 900 MHz, D₂O, predicted)		2021-09-29	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 900 MHz, D₂O, predicted)		2021-09-29	View Spectrum

Biological Properties

Cellular Locations

Endoplasmic reticulum
Golgi apparatus

Biospecimen Locations

Feces
Liver
Placenta

Tissue Locations

Liver
Placenta

Associated OMIM IDs

114500 (Colorectal cancer)
610247 (Eosinophilic esophagitis)

Human Proteins and Enzymes

Protein ID	Protein Name	Protein Type	Uniprot ID	Species
MMDBp0192111	UDP-glucuronosyltransferase 2B28	Enzyme	Q9BY64	Homo sapiens
MMDBp0192118	UDP-glucuronosyltransferase 2B4	Enzyme	P06133	Homo sapiens
MMDBp0192135	UDP-glucuronosyltransferase 1-4	Enzyme	P22310	Homo sapiens
MMDBp0192136	UDP-glucuronosyltransferase 2B10	Enzyme	P36537	Homo sapiens
MMDBp0192137	UDP-glucuronosyltransferase 2B7	Enzyme	P16662	Homo sapiens
MMDBp0192138	UDP-glucuronosyltransferase 2B15	Enzyme	P54855	Homo sapiens
MMDBp0192139	UDP-glucuronosyltransferase 2A1	Enzyme	Q9Y4X1	Homo sapiens
MMDBp0192140	UDP-glucuronosyltransferase 1-1	Enzyme	P22309	Homo sapiens
MMDBp0192141	UDP-glucuronosyltransferase 1-9	Enzyme	O60656	Homo sapiens
MMDBp0192142	UDP-glucuronosyltransferase 1-8	Enzyme	Q9HAW9	Homo sapiens
MMDBp0192143	UDP-glucuronosyltransferase 1-3	Enzyme	P35503	Homo sapiens
MMDBp0192144	UDP-glucuronosyltransferase 1-10	Enzyme	Q9HAW8	Homo sapiens
MMDBp0192145	UDP-glucuronosyltransferase 2B17	Enzyme	O75795	Homo sapiens
MMDBp0192146	UDP-glucuronosyltransferase 1-6	Enzyme	P19224	Homo sapiens
MMDBp0192147	UDP-glucuronosyltransferase 1-5	Enzyme	P35504	Homo sapiens
MMDBp0192148	UDP-glucuronosyltransferase 2B11	Enzyme	O75310	Homo sapiens
MMDBp0192151	UDP-glucuronosyltransferase 1-7	Enzyme	Q9HAW7	Homo sapiens
MMDBp0192525	UDP-glucose 6-dehydrogenase	Unknown	O60701	Homo sapiens
MMDBp0192551	Galactosylgalactosylxylosylprotein 3-beta-glucuronosyltransferase 3	Unknown	O94766	Homo sapiens
MMDBp0192552	Galactosylgalactosylxylosylprotein 3-beta-glucuronosyltransferase 2	Unknown	Q9NPZ5	Homo sapiens
MMDBp0192553	Galactosylgalactosylxylosylprotein 3-beta-glucuronosyltransferase 1	Unknown	Q9P2W7	Homo sapiens
MMDBp0192709	Chondroitin sulfate synthase 3	Unknown	Q70JA7	Homo sapiens
MMDBp0192710	Chondroitin sulfate synthase 2	Unknown	Q8IZ52	Homo sapiens
MMDBp0192711	Chondroitin sulfate synthase 1	Unknown	Q86X52	Homo sapiens
MMDBp0193208	Exostosin-1	Enzyme	Q16394	Homo sapiens
MMDBp0193209	Hyaluronan synthase 1	Unknown	Q92839	Homo sapiens
MMDBp0193211	Exostosin-2	Enzyme	Q93063	Homo sapiens
MMDBp0193216	Hyaluronan synthase 3	Unknown	O00219	Homo sapiens
MMDBp0193308	Hyaluronan synthase 2	Unknown	Q92819	Homo sapiens
MMDBp0193746	Chondroitin sulfate glucuronyltransferase	Enzyme	Q9P2E5	Homo sapiens
MMDBp0193842	UDP-glucuronic acid decarboxylase 1	Unknown	Q8NBZ7	Homo sapiens
MMDBp0194142	UDP-glucuronosyltransferase 2A3	Enzyme	Q6UWM9	Homo sapiens
MMDBp0195932	HCG2039726, isoform CRA_f	Enzyme	Q5DT02	Homo sapiens
MMDBp0195933	HCG2039726, isoform CRA_e	Enzyme	Q5DSZ6	Homo sapiens
MMDBp0195934	UDP glycosyltransferase 1 family polypeptide A7	Enzyme	Q5DSZ7	Homo sapiens
MMDBp0197010	UDP-glucuronosyltransferase 3A1	Unknown	Q6NUS8
MMDBp0197011	UDP-glucuronosyltransferase 3A2	Unknown	Q3SY77

Human Pathways

Pathways

Name	SMPDB/PathBank

Metabolic Reactions

Reaction ID	Precursor	Product	Enzyme	Reaction Type	Data Source	Reference
MMDBr0001416	Uridine diphosphate-N-acetylglucosamine	Hydrogen Ion	Hyaluronan synthase 1	Hyaluronan Synthase	VMH	12512858 8651928 8798477 8798544 9083017
MMDBr0001417	Hyaluronan biosynthesis, precursor 1	Hydrogen Ion	Hyaluronan synthase 1	Hyaluronan Synthase	VMH	12512858 8651928 8798477 8798544 9083017
MMDBr0002309	Water	D-Glucuronate 1-phosphate	Not Available	UDPglucuronate Uridine-Monophosphohydrolase	VMH	30371894
MMDBr0002312	Water	Hydrogen Ion	Udp-glucose 6-dehydrogenase	UDPglucose 6-Dehydrogenase	VMH	30371894
MMDBr0002313	UDP-Glucuronic acid	UDP-Glucuronic acid	Solute carrier family 35 (udp-glca/udp-galnac transporter), member d1	UDPglca Endoplasmic Reticulum Transport via UMP Antiport	VMH	11322953
MMDBr0002314	UDP-Glucuronic acid	UDP-Glucuronic acid	Not Available	UDPglca Golgi Transport via UMP Antiport	VMH	30371894
MMDBr0002317	Hydrogen Ion	Carbon dioxide	Udp-glucuronate decarboxylase 1	UDP-D-Glucuronate Decarboxylase, Golgi Apparatus	VMH	30371894
MMDBr0002318	Water	D-Glucuronic acid	Not Available	UDPglucuronate Uridine-Diphosphohydrolase	VMH	30371894
MMDBr0002327	Bilirubin	Mono(Glucosyluronic Acid)Bilirubin	Udp glucuronosyltransferase 1 family, polypeptide a1	UDP-Glucuronosyltransferase 1-10 Precursor, Microsomal	VMH	7945246
MMDBr0002328	Estrone	Estrone glucuronide	Udp glucuronosyltransferase 1 family, polypeptide a1	UDP-Glucuronosyltransferase 1-10 Precursor, Microsomal	VMH	15117964 9295054
MMDBr0002329	Bilirubin	Bilirubin diglucuronide	Udp glucuronosyltransferase 1 family, polypeptide a1	UDP-Glucuronosyltransferase 1-10 Precursor, Microsomal	VMH	15117964 9295054
MMDBr0002330	Androsterone	Androsterone glucuronide	Udp glucuronosyltransferase 1 family, polypeptide a1	UDP-Glucuronosyltransferase 1-10 Precursor, Microsomal	VMH	11300766 14643063 15117964 9295054
MMDBr0002331	Testosterone	Testosterone glucuronide	Udp glucuronosyltransferase 1 family, polypeptide a1	UDP-Glucuronosyltransferase 1-10 Precursor, Microsomal	VMH	11300766 15117964 9295054
MMDBr0002332	all-trans-Retinoic acid	Retinoyl b-glucuronide	Udp glucuronosyltransferase 1 family, polypeptide a1	UDP-Glucuronosyltransferase 1-10 Precursor, Microsomal	VMH	15117964 9295054
MMDBr0002333	13-cis-Retinoic acid	13-Cis-Retinoyl Glucuronide	Udp glucuronosyltransferase 1 family, polypeptide a1	UDP-Glucuronosyltransferase 1-10 Precursor, Microsomal (13-Cis)	VMH	14704335 1503811
MMDBr0002334	Estradiol	17-beta-Estradiol-3-glucuronide	Udp glucuronosyltransferase 1 family, polypeptide a1	UDP-Glucuronosyltransferase 1-10 Precursor, Microsomal	VMH	15117964 9295054
MMDBr0002335	Etiocholanolone	Etiocholanolone glucuronide	Udp glucuronosyltransferase 1 family, polypeptide a1	UDP-Glucuronosyltransferase 1-10 Precursor, Microsomal	VMH	15117964 9295054
MMDBr0002336	Estriol	Estriol-16-Glucuronide	Udp glucuronosyltransferase 1 family, polypeptide a1	UDP-Glucuronosyltransferase 1-10 Precursor, Microsomal	VMH	11300766 15117964 8333863 9295054
MMDBr0002337	Dihydrotestosterone	5-alpha-Dihydrotestosterone glucuronide	Udp glucuronosyltransferase 2 family, polypeptide b28	UDP-Glucuronosyltransferase 1-10 Precursor, Microsomal	VMH	11300766
MMDBr0003815	UDP-Glucuronic acid	UDP-Glucuronic acid	Not Available	Utilized Transport	VMH	16611737 18307097
MMDBr0003908	3,5-Diiodo-L-Thyronine	3,5-Diiodo-L-Thyronine-Beta-D-Glucuronoside	Udp glucuronosyltransferase 1 family, polypeptide a8	Glucuronosyltransferase	VMH	3988241 7263841 8333863
MMDBr0003909	3,5-Diiodo-L-Thyronine	3,5-Diiodo-L-Thyronine-Beta-D-Glucuronoside	Udp glucuronosyltransferase 1 family, polypeptide a10	Glucuronosyltransferase	VMH	3988241 7263841 8333863
MMDBr0003910	Thyroxine	3,5,3,5-Tetraiodo-L-Thyronine-Beta-D-Glucuronoside	Udp glucuronosyltransferase 1 family, polypeptide a8	Glucuronosyltransferase	VMH	7263841 8405382
MMDBr0003911	Thyroxine	3,5,3,5-Tetraiodo-L-Thyronine-Beta-D-Glucuronoside	Udp glucuronosyltransferase 1 family, polypeptide a10	Glucuronosyltransferase	VMH	7263841 8405382
MMDBr0003912	3,3,5 - Triiodothyronine	3,3,5-Triiodo-L-Thyronine-Beta-D-Glucuronoside	Udp glucuronosyltransferase 1 family, polypeptide a8	Glucuronosyltransferase	VMH	1339448 7263841 8405382
MMDBr0003913	3,3,5 - Triiodothyronine	3,3,5-Triiodo-L-Thyronine-Beta-D-Glucuronoside	Udp glucuronosyltransferase 1 family, polypeptide a10	Glucuronosyltransferase	VMH	1339448 7263841 8405382
MMDBr0003914	Liothyronine	3,5,3-Triiodo-L-Thyronine-Beta-D-Glucuronoside	Udp glucuronosyltransferase 1 family, polypeptide a8	Glucuronosyltransferase	VMH	7263841 8405382
MMDBr0003915	Liothyronine	3,5,3-Triiodo-L-Thyronine-Beta-D-Glucuronoside	Udp glucuronosyltransferase 1 family, polypeptide a10	Glucuronosyltransferase	VMH	7263841 8405382
MMDBr0003916	3,3-Diiodo-L-Thyronine	3,3-Diiodo-L-Thyronine-Beta-D-Glucuronoside	Udp glucuronosyltransferase 1 family, polypeptide a8	Glucuronosyltransferase	VMH	7263841
MMDBr0003917	3,3-Diiodo-L-Thyronine	3,3-Diiodo-L-Thyronine-Beta-D-Glucuronoside	Udp glucuronosyltransferase 1 family, polypeptide a10	Glucuronosyltransferase	VMH	7263841
MMDBr0003918	3,5,3,5-Tetraiodothyroacetate	3,5,3,5-Tetraiodothyroacetate-Beta-D-Glucuronoside	Udp glucuronosyltransferase 1 family, polypeptide a8	Glucuronosyltransferase	VMH	3090812 7364927 8070342 9633995
MMDBr0003919	3,5,3,5-Tetraiodothyroacetate	3,5,3,5-Tetraiodothyroacetate-Beta-D-Glucuronoside	Udp glucuronosyltransferase 1 family, polypeptide a10	Glucuronosyltransferase	VMH	3090812 7364927 8070342 9633995
MMDBr0003920	3,3,5-Triiodothyroacetate	3,3,5-Triiodothyroacetate-Beta-D-Glucuronoside	Udp glucuronosyltransferase 1 family, polypeptide a8	Glucuronosyltransferase	VMH	2229315 8070342 9633995
MMDBr0003921	3,3,5-Triiodothyroacetate	3,3,5-Triiodothyroacetate-Beta-D-Glucuronoside	Udp glucuronosyltransferase 1 family, polypeptide a10	Glucuronosyltransferase	VMH	2229315 8070342 9633995
MMDBr0003924	3,5,3-Triiodothyroacetate	3,5,3-Triiodothyroacetate-Beta-D-Glucuronoside	Udp glucuronosyltransferase 1 family, polypeptide a8	Glucuronosyltransferase	VMH	2229315 8070342 9633995
MMDBr0003925	3,5,3-Triiodothyroacetate	3,5,3-Triiodothyroacetate-Beta-D-Glucuronoside	Udp glucuronosyltransferase 1 family, polypeptide a10	Glucuronosyltransferase	VMH	2229315 8070342 9633995
MMDBr0003926	3,5-Diiodothyroacetate	3,5-Diiodothyroacetate-Beta-D-Glucuronoside	Udp glucuronosyltransferase 1 family, polypeptide a8	Glucuronosyltransferase	VMH	2627761 7410532 8070342 9633995
MMDBr0003927	3,5-Diiodothyroacetate	3,5-Diiodothyroacetate-Beta-D-Glucuronoside	Udp glucuronosyltransferase 1 family, polypeptide a10	Glucuronosyltransferase	VMH	2627761 7410532 8070342 9633995
MMDBr0004187	13-cis-Retinoic acid	13-Cis-Retinoyl Glucuronide	Udp glucuronosyltransferase 1 family, polypeptide a8	Glucuronosyltransferase	VMH	10702251
MMDBr0004188	4-Hydroxy-All-Trans-Retinyl Acetate	Rac-4-Hydroxy-4-O-(Beta-D-Glucuronide)-All-Trans-Retinyl Acetate	Udp glucuronosyltransferase 1 family, polypeptide a8	Glucuronosyltransferase	VMH	10702251
MMDBr0004189	4-Hydroxy-All-Trans-Retinyl Acetate	Rac-4-Hydroxy-4-O-(Beta-D-Glucuronide)-All-Trans-Retinyl Acetate	Udp glucuronosyltransferase 1 family, polypeptide a10	Glucuronosyltransferase	VMH	10702251
MMDBr0004190	4-Oxo-9-Cis-Retinoate	4-Oxo-9-Cis-Retinoyl-Beta-Glucuronide	Udp glucuronosyltransferase 1 family, polypeptide a8	Glucuronosyltransferase	VMH	8295481
MMDBr0004191	4-Oxo-9-Cis-Retinoate	4-Oxo-9-Cis-Retinoyl-Beta-Glucuronide	Udp glucuronosyltransferase 1 family, polypeptide a10	Glucuronosyltransferase	VMH	8295481
MMDBr0004254	Alpha-CEHC	Alpha-Cehc-Glucuronide	Udp glucuronosyltransferase 1 family, polypeptide a8	Glucuronosyltransferase	VMH	10191290
MMDBr0004255	Alpha-CEHC	Alpha-Cehc-Glucuronide	Udp glucuronosyltransferase 1 family, polypeptide a10	Glucuronosyltransferase	VMH	10191290
MMDBr0004256	gamma-CEHC	Gama-Cehc-Glucuronide	Udp glucuronosyltransferase 1 family, polypeptide a8	Glucuronosyltransferase	VMH	10191290
MMDBr0004257	gamma-CEHC	Gama-Cehc-Glucuronide	Udp glucuronosyltransferase 1 family, polypeptide a10	Glucuronosyltransferase	VMH	10191290
MMDBr0004310	2-Hydroxyamino-3,8-Dimethylimidazo[4,5-F]Quinoxaline	2-Hydroxyamino-Meiqx-N2-(Beta-1-Glucosiduronyl)-2-Hydroxyamino-3,8-Dimethylimidazo[4,5-F]Quinoxaline	Udp glucuronosyltransferase 1 family, polypeptide a8	Glucuronosyltransferase	VMH	10537291
MMDBr0004311	2-Hydroxyamino-3,8-Dimethylimidazo[4,5-F]Quinoxaline	2-Hydroxyamino-Meiqx-N2-(Beta-1-Glucosiduronyl)-2-Hydroxyamino-3,8-Dimethylimidazo[4,5-F]Quinoxaline	Udp glucuronosyltransferase 1 family, polypeptide a10	Glucuronosyltransferase	VMH	10537291
MMDBr0004671	12,13-DHOME	12-Hydroxy-13-O-D-Glucuronoside-Octadec-9Z-Enoate	Udp glucuronosyltransferase 1 family, polypeptide a8	Glucuronosyltransferase	VMH	10933884
MMDBr0004672	12,13-DHOME	12-Hydroxy-13-O-D-Glucuronoside-Octadec-9Z-Enoate	Udp glucuronosyltransferase 1 family, polypeptide a10	Glucuronosyltransferase	VMH	10933884
MMDBr0004673	9,10-DHOME	9-Hydroxy-10-O-D-Glucuronoside-12Z-Octadecenoate	Udp glucuronosyltransferase 1 family, polypeptide a8	Glucuronosyltransferase	VMH	10933884
MMDBr0004674	9,10-DHOME	9-Hydroxy-10-O-D-Glucuronoside-12Z-Octadecenoate	Udp glucuronosyltransferase 1 family, polypeptide a10	Glucuronosyltransferase	VMH	10933884
MMDBr0004676	12,13-DHOME	12-O-D-Glucuronoside-13-Hydroxyoctadec-9Z-Enoate	Udp glucuronosyltransferase 1 family, polypeptide a8	Glucuronosyltransferase	VMH	10933884
MMDBr0004677	12,13-DHOME	12-O-D-Glucuronoside-13-Hydroxyoctadec-9Z-Enoate	Udp glucuronosyltransferase 1 family, polypeptide a10	Glucuronosyltransferase	VMH	10933884
MMDBr0004678	9,10-DHOME	10-Hydroxy-Octadec-12Z-Enoate-9-Beta-D-Glucuronide	Udp glucuronosyltransferase 1 family, polypeptide a8	Glucuronosyltransferase	VMH	10933884
MMDBr0004679	9,10-DHOME	10-Hydroxy-Octadec-12Z-Enoate-9-Beta-D-Glucuronide	Udp glucuronosyltransferase 1 family, polypeptide a10	Glucuronosyltransferase	VMH	10933884
MMDBr0005431	Mono(Glucosyluronic Acid)Bilirubin	Bilirubin diglucuronide	Udp glucuronosyltransferase 1 family, polypeptide a1	Bilirubin Di-Glucuronide Production	VMH	30371894
MMDBr0005598	UDP-Glucuronic acid	UDP-Glucuronic acid	Not Available	Transport of UDP-Glucuronate	VMH	30371894
MMDBr0006784	Bilirubin	Mono(Glucosyluronic Acid)Bilirubin	Not Available	UDP-Glucuronosyltransferase 1-10 Precursor, Cytosol	VMH	30371894
MMDBr0007990	Water	Hydrogen Ion	Not Available	UDPglucoseNAD+ oxidoreductase	VMH	30371894
MMDBr0009063	Dopamine	Dopamine glucuronide	Chondroitin polymerizing factor	Dopamine 4-O-Glucuronidation	VMH	30371894
MMDBr0009064	Dopamine	Dopamine-3-O-Glucuronide	Chondroitin polymerizing factor	Dopamine 3-O-Glucuronidation	VMH	30371894
MMDBr0010273	Hydrogen Ion	Carbon dioxide	Udp-glucuronate decarboxylase 1	UDP-D-Glucuronate Carboxy-Lyase (UDP-D-Xylose-Forming)	VMH	30371894
MMDBr0010405	Hydrogen Ion	3-Hydroxykynurenine-O-Beta-D-Glucoside	Not Available	HMR_6720	VMH	30371894
MMDBr0010492	2,2,2-Trichloroethanol	Hydrogen Ion	Udp glucuronosyltransferase 1 family, polypeptide a1	UDP-Glucuronate Beta-D-Glucuronosyltransferase	VMH	30371894
MMDBr0010516	4-(Methylnitrosamino)-1-(3-Pyridyl)-1-Butanol	4-(Methylnitrosamino)-1-(3-pyridyl)-1-butanol glucuronide	Udp glucuronosyltransferase 1 family, polypeptide a1	Glucuronosyltransferase	VMH	30371894
MMDBr0010517	4-(Methylnitrosamino)-1-(3-Pyridyl)-1-Butanol	Nnal-N-Glucuronide	Udp glucuronosyltransferase 1 family, polypeptide a1	Glucuronosyltransferase	VMH	30371894
MMDBr0010822	5,6-Epoxy-13-Cis-Retinoate	Rac-5,6-Epoxy-Retinoyl-Beta-D-Glucuronide	Udp glucuronosyltransferase 1 family, polypeptide a1	Glucuronosyltransferase	VMH	30371894
MMDBr0012380	Deoxycholic acid	Deoxycholic acid 3-glucuronide	Udp glucuronosyltransferase 2 family, polypeptide a1, complex locus	UDP-Glucuronosyltransferase (UGT) cytosolic (deoxycholic acid)	VMH	30371894
MMDBr0012381	Deoxycholic acid	Deoxycholic acid 3-glucuronide	Udp glucuronosyltransferase 2 family, polypeptide a1, complex locus	UDP-Glucuronosyltransferase (UGT) ER (deoxycholic acid)	VMH	30371894
MMDBr0012423	Acetaminophen	Acetaminophen Glucuronide	Udp glucuronosyltransferase 1 family, polypeptide a6	glucuronidation of acetaminophen in hepatocytes	VMH	30371894
MMDBr0013006	UDP-Glucuronic acid	UDP-alpha-D-galacturonic acid	Probable UDP-glucuronate 4-epimerase	Epimerization	RHEA	34755880
MMDBr0014357	Water	Hydrogen Ion	UDP-glucose 6-dehydrogenase AglM	Dehydrogenation	RHEA	34755880
MMDBr0014477	NAD	Carbon dioxide	Bifunctional polymyxin resistance protein ArnA	Oxidative decarboxylation	RHEA	34755880
MMDBr0014478	NAD	Carbon dioxide	Bifunctional polymyxin resistance protein ArnA	Oxidative decarboxylation	RHEA	34755880
MMDBr0015001	alpha-D-Man-(1->3)-beta-D-Glc-(1->4)-alpha-D-Glc-1-di-trans,octa-cis-undecaprenyl diphosphate	beta-D-GlcA-(1->2)-alpha-D-Man-(1->3)-beta-D-Glc-(1->4)-alpha-D-Glc-di-trans,octa-cis-undecaprenyl diphosphate	UDP-glucuronate:glycolipid 2-beta-glucuronosyltransferase	Transfer of a glucuronosyl group	RHEA	34755880
MMDBr0018473	Water	Hydrogen Ion	UDP-glucose 6-dehydrogenase	Dehydrogenation	PathBank	31602464
MMDBr0018474	NAD	Carbon dioxide	Bifunctional polymyxin resistance protein ArnA	Oxidative decarboxylation	PathBank	31602464
MMDBr0019752	Bilirubin	Uridine 5'-diphosphate	Not Available		PathBank	31602464
MMDBr0024417	UDP-Glucuronic acid	Hydrogen Ion	Hyaluronan synthase	Synthesis	RHEA	34755880
MMDBr0024740	UDP-Glucuronic acid	Hydrogen Ion	Hyaluronan synthase	Synthesis	RHEA	34755880
MMDBr0025540	UDP-Glucuronic acid	Hydrogen Ion	Hyaluronan synthase	Synthesis	RHEA	34755880
MMDBr0025597	UDP-Glucuronic acid	Hydrogen Ion	Glucosyl-dolichyl phosphate glucuronosyltransferase	Transfer of a glucuronosyl group	RHEA	34755880
MMDBr0025598	UDP-Glucuronic acid	Hydrogen Ion	Glucosyl-dolichyl phosphate glucuronosyltransferase	Transfer of a glucuronosyl group	RHEA	34755880

Health Effects and Bioactivity

Health Outcome/Bioactivity	Metabolite Response/Effect	Evidence Type	Host and Biospecimen	Data Source	Reference

Microbial Sources

Superkingdom/Kingdom	Phylum	Total species	Hosts and Body Sites	Microbial Links
Bacteria	Proteobacteria	236	Human feces; Human sputum; Human ; Human unknown; Pig ; Human pleural fluid plaque; Human dental plaque; Human nasal swab; Human stool; Human feces; pleural fluid plaque; bal; River trout	Unknown; Metabolic reconstruction
Bacteria	Firmicutes	230	Pig ; Human feces; Human sputum; Human ; Human subgingival plaque; Human saliva; Human urine; Human mucosa; Cattle ; Human stool	Metabolic reconstruction
Bacteria	Actinobacteria	79	Human feces; Human pleural fluid plaque; Human dental plaque; Human sputum; Human ; Human mucosa; Human supragingival plaque; Human subgingival plaque	Metabolic reconstruction
Bacteria	Verrucomicrobia	1	Human ; Human feces	Metabolic reconstruction
Bacteria	Bacteroidetes	126	Human feces; Human appendix biopsy; Human ; Human stool; Human saliva; Human gastric fluid; Human urine; Human subgingival plaque; Human supragingival plaque	Metabolic reconstruction
Bacteria	Synergistetes	3	Human feces	Metabolic reconstruction
Bacteria	Spirochaetes	1	Human feces	Metabolic reconstruction
Bacteria	Fusobacteria	12	Human feces; Human	Metabolic reconstruction
Archaea	Euryarchaeota	5		Metabolic reconstruction
Bacteria	Candidatus melainabacteria	1	Human feces	Metabolic reconstruction
Bacteria	Planctomycetes	1	Human feces	Metabolic reconstruction
Archaea	Crenarchaeota	1		Metabolic reconstruction
Bacteria	Thermodesulfobacteria	1
Archaea/Archaea	Euryarchaeota	1		Metabolic reconstruction
Bacteria/NULL	Proteobacteria	1	Human feces; Human sputum; Human ; Human unknown; Pig ; Human pleural fluid plaque; Human dental plaque; Human nasal swab; Human stool; Human feces; pleural fluid plaque; bal; River trout	Unknown; Metabolic reconstruction
Eukaryota/Fungi	Ascomycota	1	Human feces; Human saliva	Unknown

Exposure Sources

Source Type	Species	Data Source	Reference
Animal	Chondrus crispus	FooDB	31437929
Animal	Laminaria	FooDB	31437929
Animal	Haliotis	FooDB	31437929
Animal	Strombidae	FooDB	31437929
Animal	Clupea harengus harengus	FooDB	31437929
Animal	Undaria pinnatifida	FooDB	31437929
Animal	Peprilus triacanthus	FooDB	31437929
Animal	Rhodophyta	FooDB	31437929
Animal	Myoxocephalus	FooDB	31437929
Animal	Eucheuma	FooDB	31437929
Animal	Saccharina japonica	FooDB	31437929
Animal	Spirulina	FooDB	31437929
Animal	Lota lota	FooDB	31437929
Animal	Porphyra umbilicalis	FooDB	31437929
Plant	Opuntia cochenillifera	FooDB	31437929
Plant	Vaccinium ovatum	FooDB	31437929
Plant	Cocos nucifera	FooDB	31437929
Plant	Phaseolus coccineus	FooDB	31437929
Plant	Thymus pulegioides	FooDB	31437929
Plant	Tamarindus indica	FooDB	31437929
Plant	Mespilus germanica	FooDB	31437929
Plant	Brassica rapa var. perviridis	FooDB	31437929
Plant	Cucurbita pepo var. cylindrica	FooDB	31437929
Plant	Mentha aquatica	FooDB	31437929
Plant	Salvia elegans	FooDB	31437929
Plant	Mentha	FooDB	31437929
Plant	Sagittaria latifolia	FooDB	31437929
Plant	Solanum tuberosum	FooDB	31437929
Plant	Olea europaea	FooDB	31437929
Plant	Sambucus	FooDB	31437929
Plant	Pinus	FooDB	31437929
Plant	Psidium guajava	FooDB	31437929
Plant	Syzygium cumini	FooDB	31437929
Plant	Tilia tomentosa	FooDB	31437929
Plant	Typha angustifolia	FooDB	31437929
Plant	Daucus carota	FooDB	31437929
Plant	Empetrum nigrum	FooDB	31437929
Plant	Valerianella locusta	FooDB	31437929
Plant	Myrica rubra	FooDB	31437929
Plant	Vaccinium vitis-idaea	FooDB	31437929
Plant	Vaccinium angustifolium x vaccinium corymbosum	FooDB	31437929
Plant	Sisymbrium	FooDB	31437929
Plant	Vanilla	FooDB	31437929
Plant	Carya	FooDB	31437929
Plant	Brassica oleracea l. var. capitata l. f. alba dc.	FooDB	31437929
Plant	Physalis philadelphica var. immaculata	FooDB	31437929
Plant	Vigna radiata	FooDB	31437929
Plant	Borago officinalis	FooDB	31437929
Plant	Raphanus sativus	FooDB	31437929
Plant	Prunus dulcis	FooDB	31437929
Plant	Hyssopus officinalis	FooDB	31437929
Plant	Manihot esculenta	FooDB	31437929
Plant	Beta vulgaris ssp. cicla	FooDB	31437929
Plant	Scorzonera hispanica	FooDB	31437929
Plant	Vigna unguiculata ssp. sesquipedalis	FooDB	31437929
Plant	Angelica keiskei	FooDB	31437929
Plant	Ipomoea aquatica	FooDB	31437929
Plant	Musa x paradisiaca	FooDB	31437929
Plant	Cuminum cyminum	FooDB	31437929
Plant	Rubus spectabilis	FooDB	31437929
Plant	Allium sativum	FooDB	31437929
Plant	Arachis hypogaea	FooDB	31437929
Plant	Rubus idaeus	FooDB	31437929
Plant	Cantharellus cibarius	FooDB	31437929
Plant	Sinapis alba	FooDB	31437929
Plant	Fragaria x ananassa	FooDB	31437929
Plant	Pyrus communis	FooDB	31437929
Plant	Brassica ruvo	FooDB	31437929
Plant	Apium graveolens var. secalinum	FooDB	31437929
Plant	Morus nigra	FooDB	31437929
Plant	Solanum lycopersicum	FooDB	31437929
Plant	Abelmoschus esculentus	FooDB	31437929
Plant	Moringa oleifera	FooDB	31437929
Plant	Pinus edulis	FooDB	31437929
Plant	Passiflora edulis	FooDB	31437929
Plant	Opuntia macrorhiza	FooDB	31437929
Plant	Vigna angularis	FooDB	31437929
Plant	Manilkara zapota	FooDB	31437929
Plant	Cucurbita pepo var. clypeata	FooDB	31437929
Plant	Helianthus annuus	FooDB	31437929
Plant	Mentha spicata	FooDB	31437929
Plant	Corylus	FooDB	31437929
Plant	Malus	FooDB	31437929
Plant	Pisum sativum	FooDB	31437929
Plant	Sambucus nigra	FooDB	31437929
Plant	Allium cepa	FooDB	31437929
Plant	Juglans	FooDB	31437929
Plant	Mangifera indica	FooDB	31437929
Plant	Petroselinum crispum	FooDB	31437929
Plant	Ribes nigrum	FooDB	31437929
Plant	Zingiber officinale	FooDB	31437929
Plant	Chamaemelum nobile	FooDB	31437929
Plant	Illicium verum	FooDB	31437929
Plant		FooDB	31437929
Plant	Laurus nobilis	FooDB	31437929
Plant	Auricularia auricula-judae	FooDB	31437929
Plant	Attalea speciosa	FooDB	31437929
Plant	Juglans ailanthifolia	FooDB	31437929
Plant	Melissa officinalis	FooDB	31437929
Plant	Hippophae rhamnoides	FooDB	31437929
Plant	Polygonum alpinum	FooDB	31437929
Plant	Brassica juncea	FooDB	31437929
Plant	Pediomelum esculentum	FooDB	31437929
Plant	Spinacia oleracea	FooDB	31437929
Plant	Auricularia polytricha	FooDB	31437929
Plant	Camellia oleifera	FooDB	31437929
Plant	Vaccinium corymbosum	FooDB	31437929
Plant	Chrysanthemum coronarium	FooDB	31437929
Plant	Eleocharis dulcis	FooDB	31437929
Plant	Thymus vulgaris	FooDB	31437929
Plant	Actinidia chinensis	FooDB	31437929
Plant	Carica papaya	FooDB	31437929
Plant	Pimenta dioica	FooDB	31437929
Plant	Medicago sativa	FooDB	31437929
Plant	Vigna mungo	FooDB	31437929
Plant	Rubus arcticus	FooDB	31437929
Plant	Agaricus bisporus	FooDB	31437929
Plant	Cajanus cajan	FooDB	31437929
Plant	Rumex articus	FooDB	31437929
Plant	Origanum majorana	FooDB	31437929
Plant	Armoracia rusticana	FooDB	31437929
Plant	Hibiscus sabdariffa	FooDB	31437929
Plant	Benincasa hispida	FooDB	31437929
Plant	Prunus persica	FooDB	31437929
Plant	Canarium ovatum	FooDB	31437929
Plant	Ribes aureum var. villosum	FooDB	31437929
Plant	Cucurbita pepo var. cylindrica	FooDB	31437929
Plant	Brassica oleracea var. gemmifera	FooDB	31437929
Plant	Foeniculum vulgare	FooDB	31437929
Plant	Phoenix dactylifera	FooDB	31437929
Plant	Vaccinium macrocarpon	FooDB	31437929
Plant		FooDB	31437929
Plant	Arctium lappa	FooDB	31437929
Plant	Brassica oleracea var. gongylodes	FooDB	31437929
Plant	Juglans cinerea	FooDB	31437929
Plant	Prunus cerasus	FooDB	31437929
Plant	Eruca vesicaria ssp. sativa	FooDB	31437929
Plant	Rosmarinus officinalis	FooDB	31437929
Plant	Artocarpus altilis	FooDB	31437929
Plant	Citrus x paradisi	FooDB	31437929
Plant	Vigna unguiculata	FooDB	31437929
Plant	Cynara scolymus	FooDB	31437929
Plant	Cyathea	FooDB	31437929
Plant	Metroxylon sagu	FooDB	31437929
Plant	Vitis rotundifolia	FooDB	31437929
Plant	Brosimum alicastrum	FooDB	31437929
Plant	Ficus carica	FooDB	31437929
Plant	Lentinus edodes	FooDB	31437929
Plant	Psidium cattleianum	FooDB	31437929
Plant	Beta vulgaris var. rubra	FooDB	31437929
Plant	Castanea mollissima	FooDB	31437929
Plant	Lepidium sativum	FooDB	31437929
Plant	Morus	FooDB	31437929
Plant	Helianthus tuberosus	FooDB	31437929
Plant	Phytolacca americana	FooDB	31437929
Plant	Grifola frondosa	FooDB	31437929
Plant	Vitis labrusca	FooDB	31437929
Plant	Tetragonia tetragonioides	FooDB	31437929
Plant	Artemisia vulgaris	FooDB	31437929
Plant	Cucumis metuliferus	FooDB	31437929
Plant	Nephelium lappaceum	FooDB	31437929
Plant	Myrica	FooDB	31437929
Plant		FooDB	31437929
Plant	Corylus avellana	FooDB	31437929
Plant	Castanea crenata	FooDB	31437929
Plant	Litchi chinensis	FooDB	31437929
Plant	Juglans regia	FooDB	31437929
Plant	Quercus	FooDB	31437929
Plant	Trigonella foenum-graecum	FooDB	31437929
Plant	Vaccinium angustifolium	FooDB	31437929
Plant	Malpighia emarginata	FooDB	31437929
Plant	Physalis	FooDB	31437929
Plant	Brassica oleracea var. sabauda	FooDB	31437929
Plant	Thelesperma	FooDB	31437929
Plant	Brassica napus	FooDB	31437929
Plant	Asparagus officinalis	FooDB	31437929
Plant	Chamerion angustifolium	FooDB	31437929
Plant	Levisticum officinale	FooDB	31437929
Plant	Pimpinella anisum	FooDB	31437929
Plant	Vaccinium elliottii	FooDB	31437929
Plant	Artemisia dracunculus	FooDB	31437929
Plant	Matricaria recutita	FooDB	31437929
Plant	Citrus aurantiifolia	FooDB	31437929
Plant	Ziziphus zizyphus	FooDB	31437929
Plant	Lactuca sativa	FooDB	31437929
Plant	Dimocarpus longan	FooDB	31437929
Plant	Eragrostis tef	FooDB	31437929
Plant	Salvia hispanica	FooDB	31437929
Plant	Pistacia vera	FooDB	31437929
Plant	Cynara cardunculus	FooDB	31437929
Plant	Vitellaria paradoxa	FooDB	31437929
Plant	Pangium edule	FooDB	31437929
Plant	Malus pumila	FooDB	31437929
Plant	Allium	FooDB	31437929
Plant	Brassica oleracea var. viridis	FooDB	31437929
Plant	Punica granatum	FooDB	31437929
Plant	Agave	FooDB	31437929
Plant	Hedysarum alpinum	FooDB	31437929
Plant	Diospyros	FooDB	31437929
Plant		FooDB	31437929
Plant	Vigna aconitifolia	FooDB	31437929
Plant	Amaranthus	FooDB	31437929
Plant	Gossypium	FooDB	31437929
Plant	Beta vulgaris	FooDB	31437929
Plant	Mammea americana	FooDB	31437929
Plant	Brassica alboglabra	FooDB	31437929
Plant	Annona squamosa	FooDB	31437929
Plant	Apium graveolens var. dulce	FooDB	31437929
Plant	Vitis	FooDB	31437929
Plant	Xanthosoma sagittifolium	FooDB	31437929
Plant	Basella alba	FooDB	31437929
Plant	Cucumis sativus	FooDB	31437929
Plant	Citrus latifolia	FooDB	31437929
Plant	Carya illinoinensis	FooDB	31437929
Plant	Capsicum baccatum var. baccatum	FooDB	31437929
Plant	Byrsonima crassifolia	FooDB	31437929
Plant	Capsicum pubescens	FooDB	31437929
Plant	Cinnamomum aromaticum	FooDB	31437929
Plant	Ribes rubrum	FooDB	31437929
Plant	Crateva religiosa	FooDB	31437929
Plant		FooDB	31437929
Plant	Vitis aestivalis	FooDB	31437929
Plant	Brassica rapa var. chinensis	FooDB	31437929
Plant	Eugenia javanica	FooDB	31437929
Plant	Portulaca oleracea	FooDB	31437929
Plant	Ipomoea batatas	FooDB	31437929
Plant	Mentha arvensis	FooDB	31437929
Plant	Pastinaca sativa	FooDB	31437929
Plant	Cucurbita maxima	FooDB	31437929
Plant	Vaccinium stamineum	FooDB	31437929
Plant	Solanum lycopersicum var. cerasiforme	FooDB	31437929
Plant	Chenopodium album	FooDB	31437929
Plant	Psophocarpus tetragonolobus	FooDB	31437929
Plant	Allium ampeloprasum	FooDB	31437929
Plant	Brassica oleracea	FooDB	31437929
Plant	Sechium edule	FooDB	31437929
Plant	Lactuca sativa l. var. longifolia	FooDB	31437929
Plant	Grataegosorbus mitschurinii	FooDB	31437929
Plant	Diospyros virginiana	FooDB	31437929
Plant	Origanum x majoricum	FooDB	31437929
Plant	Rubus x loganobaccus	FooDB	31437929
Plant	Tragopogon porrifolius	FooDB	31437929
Plant	Taraxacum officinale	FooDB	31437929
Plant	Rumex	FooDB	31437929
Plant	Allium ascalonicum	FooDB	31437929
Plant	Curcuma longa	FooDB	31437929
Plant	Rubus chamaemorus	FooDB	31437929
Plant	Elettaria cardamomum	FooDB	31437929
Plant	Citrullus lanatus var. fistulosus	FooDB	31437929
Plant	Ananas comosus	FooDB	31437929
Plant	Persea americana	FooDB	31437929
Plant	Amelanchier alnifolia	FooDB	31437929
Plant	Eugenia uniflora	FooDB	31437929
Plant	Annona reticulata	FooDB	31437929
Plant	Cichorium intybus	FooDB	31437929
Plant	Sesbania bispinosa	FooDB	31437929
Plant	Chenopodium quinoa	FooDB	31437929
Plant	Brassica oleracea var. botrytis	FooDB	31437929
Plant	Ribes x nidigrolaria	FooDB	31437929
Plant	Garcinia mangostana	FooDB	31437929
Plant	Cucumis melo	FooDB	31437929
Plant	Dioscorea pentaphylla	FooDB	31437929
Plant	Corchorus olitorius	FooDB	31437929
Plant	Juglans nigra	FooDB	31437929
Plant	Lathyrus sativus	FooDB	31437929
Plant	Allium tuberosum	FooDB	31437929
Plant	Cinnamomum verum	FooDB	31437929
Plant	Glycine max	FooDB	31437929
Plant	Gaylussacia baccata	FooDB	31437929
Plant	Petasites japonicus	FooDB	31437929
Plant	Prunus tomentosa	FooDB	31437929
Plant	Ocimum basilicum	FooDB	31437929
Plant	Mentha x piperita	FooDB	31437929
Plant	Maranta arundinacea	FooDB	31437929
Plant	Matteuccia struthiopteris	FooDB	31437929
Plant	Cucurbita moschata	FooDB	31437929
Plant	Macadamia	FooDB	31437929
Plant	Tilia	FooDB	31437929
Plant	Citrus limon	FooDB	31437929
Plant	Vaccinium myrtilloides	FooDB	31437929
Plant	Capsicum annuum var. annuum	FooDB	31437929
Plant	Apium graveolens var. rapaceum	FooDB	31437929
Plant	Papaver	FooDB	31437929
Plant	Rosa	FooDB	31437929
Plant	Nelumbo	FooDB	31437929
Plant	Brassica oleracea var. conica	FooDB	31437929
Plant	Sesamum orientale	FooDB	31437929
Plant	Annona cherimola	FooDB	31437929
Plant	Brassica rapa var. pekinensis	FooDB	31437929
Plant	Brassica rapa	FooDB	31437929
Plant	Lippia graveolens	FooDB	31437929
Plant	Prunus	FooDB	31437929
Plant	Capparis spinosa	FooDB	31437929
Plant	Citrus sinensis	FooDB	31437929
Plant	Lens culinaris	FooDB	31437929
Plant	Vaccinium deliciosum	FooDB	31437929
Plant	Phaseolus lunatus	FooDB	31437929
Plant	Artocarpus heterophyllus	FooDB	31437929
Plant	Prunus virginiana	FooDB	31437929
Plant	Musa acuminata	FooDB	31437929
Plant	Citrullus lanatus	FooDB	31437929
Plant	Linum usitatissimum	FooDB	31437929
Plant	Vigna unguiculata ssp. unguiculata	FooDB	31437929
Plant	Macadamia tetraphylla	FooDB	31437929
Plant	Phyllostachys edulis	FooDB	31437929
Plant	Lagenaria siceraria	FooDB	31437929
Plant	Prunus domestica	FooDB	31437929
Plant	Prunus armeniaca	FooDB	31437929
Plant	Carum carvi	FooDB	31437929
Plant	Allium schoenoprasum	FooDB	31437929
Plant	Carissa macrocarpa	FooDB	31437929
Plant	Citrus reticulata	FooDB	31437929
Plant	Satureja hortensis	FooDB	31437929
Plant	Averrhoa carambola	FooDB	31437929
Plant	Brassica rapa var. rapa	FooDB	31437929
Plant	Sorbus aucuparia	FooDB	31437929
Plant	Anethum graveolens	FooDB	31437929
Plant	Nelumbo nucifera	FooDB	31437929
Plant	Coriandrum sativum	FooDB	31437929
Plant	Bertholletia excelsa	FooDB	31437929
Plant	Brassica oleracea var. costata	FooDB	31437929
Plant	Panax	FooDB	31437929
Plant	Ceratonia siliqua	FooDB	31437929
Plant	Cymbopogon citratus	FooDB	31437929
Plant	Luffa aegyptiaca	FooDB	31437929
Plant	Anacardium occidentale	FooDB	31437929
Plant	Carthamus tinctorius	FooDB	31437929
Plant	Rubus occidentalis	FooDB	31437929
Plant	Vigna umbellata	FooDB	31437929
Plant	Cicer arietinum	FooDB	31437929
Plant	Allium fistulosum	FooDB	31437929
Plant	Capsicum	FooDB	31437929
Plant	Vaccinium alaskaense	FooDB	31437929
Plant	Lupinus	FooDB	31437929
Plant	Tilia cordata	FooDB	31437929
Plant	Camellia sinensis	FooDB	31437929
Plant	Prunus persica var. nucipersica	FooDB	31437929
Plant	Durio zibethinus	FooDB	31437929
Plant	Eriobotrya japonica	FooDB	31437929
Plant	Solanum lycopersicum var. lycopersicum	FooDB	31437929
Plant	Brassica napus var. pabularia	FooDB	31437929
Plant	Oenothera biennis	FooDB	31437929
Plant	Diospyros kaki	FooDB	31437929
Plant	Ribes glandulosum	FooDB	31437929
Plant	Phaseolus vulgaris	FooDB	31437929
Plant	Theobroma cacao	FooDB	31437929
Plant	Virola surinamensis	FooDB	31437929
Plant	Verbena officinalis	FooDB	31437929
Plant	Daucus carota ssp. sativus	FooDB	31437929
Plant	Vaccinium oxycoccos	FooDB	31437929
Plant	Rumex acetosa	FooDB	31437929
Plant	Syzygium aromaticum	FooDB	31437929
Plant	Pyrus pyrifolia	FooDB	31437929
Plant	Vaccinium myrtillus	FooDB	31437929
Plant	Vaccinium parvifolium	FooDB	31437929
Plant	Aloysia triphylla	FooDB	31437929
Plant	Brassica oleracea var. capitata	FooDB	31437929
Plant	Capsicum chinense	FooDB	31437929
Plant	Vicia faba	FooDB	31437929
Plant	Vaccinium reticulatum	FooDB	31437929
Plant	Solanum quitoense	FooDB	31437929
Plant	Ginkgo biloba	FooDB	31437929
Plant	Theobroma grandiflorum	FooDB	31437929
Plant	Vigna unguiculata ssp. cylindrica	FooDB	31437929
Plant	Flammulina velutipes	FooDB	31437929
Plant	Satureja montana	FooDB	31437929
Plant		FooDB	31437929
Plant	Vitis vinifera	FooDB	31437929
Plant	Citrus japonica	FooDB	31437929
Plant	Prunus avium	FooDB	31437929
Plant	Perideridia oregana	FooDB	31437929
Plant	Vaccinium arboreum	FooDB	31437929
Plant	Pouteria sapota	FooDB	31437929
Plant	Wasabia japonica	FooDB	31437929
Plant	Piper nigrum	FooDB	31437929
Plant	Origanum onites	FooDB	31437929
Plant	Capsicum annuum	FooDB	31437929
Plant	Origanum vulgare	FooDB	31437929
Plant	Viburnum edule	FooDB	31437929
Plant	Dioscorea	FooDB	31437929
Plant	Brassica oleracea var. italica	FooDB	31437929
Plant	Momordica charantia	FooDB	31437929
Plant	Vaccinium uliginosum	FooDB	31437929
Plant	Castanea	FooDB	31437929
Plant	Rubus ursinus x idaeus	FooDB	31437929
Plant	Pleurotus ostreatus	FooDB	31437929
Plant	Cirsium	FooDB	31437929
Plant	Solanum melongena	FooDB	31437929
Plant	Opuntia	FooDB	31437929
Plant	Raphanus sativus var. sativus	FooDB	31437929
Plant	Colocasia esculenta	FooDB	31437929
Plant	Prunus persica var. persica	FooDB	31437929
Plant	Anthriscus cerefolium	FooDB	31437929
Plant	Nuphar lutea	FooDB	31437929
Plant	Lupinus albus	FooDB	31437929
Plant	Myristica fragrans	FooDB	31437929
Plant	Pachyrhizus erosus	FooDB	31437929
Plant	Cichorium endivia	FooDB	31437929
Plant	Apium graveolens	FooDB	31437929
Plant	Elaeis	FooDB	31437929
Plant	Cinnamomum	FooDB	31437929
Plant	Ribes uva-crispa	FooDB	31437929
Plant	Feijoa sellowiana	FooDB	31437929
Plant	Dysphania ambrosioides	FooDB	31437929
Plant	Raphanus sativus var. niger	FooDB	31437929
Plant	Photinia melanocarpa	FooDB	31437929
Plant	Salvia officinalis	FooDB	31437929
Plant	Rheum rhabarbarum	FooDB	31437929
Plant	Vaccinium	FooDB	31437929
Plant	Lablab purpureus	FooDB	31437929
Plant	Crocus sativus	FooDB	31437929
Plant	Citrus maxima	FooDB	31437929
Plant	Syzygium jambos	FooDB	31437929
Plant	Salix pulchra	FooDB	31437929
Plant	Castanea sativa	FooDB	31437929
Plant	Cydonia oblonga	FooDB	31437929
Plant	Annona muricata	FooDB	31437929
Plant	Fagus	FooDB	31437929
Plant	Cucurbita	FooDB	31437929

Host Biospecimen and Location

Host and Biospecimen	Status	Age	Sex	Health Condition	Data Source	Reference
Human Feces	Detected but not Quantified				HMDB
Human Liver	Detected but not Quantified	Not Specified	Not Specified	Normal	HMDB	34986597
Human Placenta	Detected but not Quantified	Not Specified	Not Specified	Normal	HMDB	34986597

External Links

HMDB ID

HMDB0000935

DrugBank ID

DB03041

Phenol Explorer Compound ID

Not Available

FooDB ID

KNApSAcK ID

Chemspider ID

KEGG Compound ID

BioCyc ID

BiGG ID

Wikipedia Link

Uridine_diphosphate_glucuronic_acid

METLIN ID

5884

PubChem Compound

17473

PDB ID

Not Available

ChEBI ID

17200

Food Biomarker Ontology

Not Available

References

Synthesis Reference

Not Available

General References

Cappiello M, Giuliani L, Pacifici GM: Distribution of UDP-glucuronosyltransferase and its endogenous substrate uridine 5'-diphosphoglucuronic acid in human tissues. Eur J Clin Pharmacol. 1991;41(4):345-50. doi: 10.1007/BF00314965. [PubMed:1804651 ]
Huskey SW, Doss GA, Miller RR, Schoen WR, Chiu SH: N-glucuronidation reactions. II. Relative N-glucuronidation reactivity of methylbiphenyl tetrazole, methylbiphenyl triazole, and methylbiphenyl imidazole in rat, monkey, and human hepatic microsomes. Drug Metab Dispos. 1994 Jul-Aug;22(4):651-8. [PubMed:7956743 ]
Hagenauer B, Salamon A, Thalhammer T, Kunert O, Haslinger E, Klingler P, Senderowicz AM, Sausville EA, Jager W: In vitro glucuronidation of the cyclin-dependent kinase inhibitor flavopiridol by rat and human liver microsomes: involvement of UDP-glucuronosyltransferases 1A1 and 1A9. Drug Metab Dispos. 2001 Apr;29(4 Pt 1):407-14. [PubMed:11259324 ]
Alkharfy KM, Frye RF: High-performance liquid chromatographic assay for acetaminophen glucuronide in human liver microsomes. J Chromatogr B Biomed Sci Appl. 2001 Apr 5;753(2):303-8. doi: 10.1016/s0378-4347(00)00566-1. [PubMed:11334344 ]
Cappiello M, Giuliani L, Rane A, Pacifici GM: Uridine 5'-diphosphoglucuronic acid (UDPGLcUA) in the human fetal liver, kidney and placenta. Eur J Drug Metab Pharmacokinet. 2000 Jul-Dec;25(3-4):161-3. doi: 10.1007/BF03192308. [PubMed:11420884 ]
Ghosal A, Hapangama N, Yuan Y, Achanfuo-Yeboah J, Iannucci R, Chowdhury S, Alton K, Patrick JE, Zbaida S: Identification of human UDP-glucuronosyltransferase enzyme(s) responsible for the glucuronidation of ezetimibe (Zetia). Drug Metab Dispos. 2004 Mar;32(3):314-20. doi: 10.1124/dmd.32.3.314. [PubMed:14977865 ]
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Showing metabocard for UDP-Glucuronic acid (MMDBc0029638)

MOL for #<Metabolite:0x00007fe2a8051da0>

3D MOL for #<Metabolite:0x00007fe2a8051da0>

3D SDF for #<Metabolite:0x00007fe2a8051da0>

3D-SDF for #<Metabolite:0x00007fe2a8051da0>

PDB for #<Metabolite:0x00007fe2a8051da0>

3D PDB for #<Metabolite:0x00007fe2a8051da0>

SMILES for #<Metabolite:0x00007fe2a8051da0>

INCHI for #<Metabolite:0x00007fe2a8051da0>

Structure for #<Metabolite:0x00007fe2a8051da0>

3D Structure for #<Metabolite:0x00007fe2a8051da0>