Record Information
Version1.0
StatusDetected and Quantified
Creation Date2021-11-17 23:39:22 UTC
Update Date2022-08-31 17:16:10 UTC
Metabolite IDMMDBc0029731
Metabolite Identification
Common Name6,7-Dimethyl-8-(1-D-ribityl)lumazine
Description6,7-Dimethyl-8-(1-D-ribityl)lumazine is an intermediate in riboflavin metabolism. 6,7-Dimethyl-8-(1-D-ribityl)lumazine is the second to last step in the synthesis of ribitol and is converted from 4-(1-D-ribitylamino)-5-amino-2,6-dihydroxypyrimidine via the enzyme riboflavin synthase beta chain. It is then
Structure
Synonyms
ValueSource
1-Deoxy-1-(3,4-dihydro-6,7-dimethyl-2,4-dioxo-8(2H)-pteridinyl)-ribitolHMDB
1-Deoxy-1-[6,7-dimethyl-2,4-dioxo-3,4-dihydropteridin-8(2H)-yl]-D-ribitolHMDB
6,7-Dimethyl-8-(1'-D-ribityl)lumazineHMDB
6,7-Dimethyl-8-ribityllumazineHMDB
6,7-Dimethyl-8-[(2S,3S,4R)-2,3,4,5-tetrahydroxypentyl]pteridine-2,4-dioneHMDB
DMDRLHMDB
Molecular FormulaC13H18N4O6
Average Mass326.3052
Monoisotopic Mass326.122634328
IUPAC Name6,7-dimethyl-8-(2,3,4,5-tetrahydroxypentyl)-2,3,4,8-tetrahydropteridine-2,4-dione
Traditional Name6,7-dimethyl-8-(2,3,4,5-tetrahydroxypentyl)-3H-pteridine-2,4-dione
CAS Registry Number5118-16-1
SMILES
CC1=C(C)N(CC(O)C(O)C(O)CO)C2=NC(=O)NC(=O)C2=N1
InChI Identifier
InChI=1S/C13H18N4O6/c1-5-6(2)17(3-7(19)10(21)8(20)4-18)11-9(14-5)12(22)16-13(23)15-11/h7-8,10,18-21H,3-4H2,1-2H3,(H,16,22,23)
InChI KeySXDXRJZUAJBNFL-UHFFFAOYSA-N