Record Information
Version1.0
StatusDetected and Quantified
Creation Date2022-06-17 20:23:36 UTC
Update Date2022-08-12 20:09:41 UTC
Metabolite IDMMDBc0056355
Metabolite Identification
Common NameUDP-N-2-acetamido-2-deoxy-alpha-D-glucuronic acid
DescriptionUDP-2-acetamido-2-deoxy-alpha-D-glucuronate(3-), also known as UDP-N-2-acetamido-2-deoxy-a-D-glucuronic acid, belongs to the class of organic compounds known as pyrimidine nucleotide sugars. These are pyrimidine nucleotides bound to a saccharide derivative through the terminal phosphate group. Based on a literature review very few articles have been published on UDP-2-acetamido-2-deoxy-alpha-D-glucuronate(3-).
Structure
Synonyms
ValueSource
(2S,3S,4R,5R,6R)-5-Acetamido-6-({[({[(2R,3S,4R,5R)-5-(2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)-3,4-dihydroxytetrahydrofuran-2-yl]methoxy}phosphinato)oxy]phosphinato}oxy)-3,4-dihydroxytetrahydro-2H-pyran-2-carboxylateChEBI
UDP-N-2-Acetamido-2-deoxy-alpha-D-glucuronateChEBI
(2S,3S,4R,5R,6R)-5-Acetamido-6-({[({[(2R,3S,4R,5R)-5-(2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)-3,4-dihydroxytetrahydrofuran-2-yl]methoxy}phosphinato)oxy]phosphinato}oxy)-3,4-dihydroxytetrahydro-2H-pyran-2-carboxylic acidGenerator
UDP-N-2-Acetamido-2-deoxy-a-D-glucuronateGenerator
UDP-N-2-Acetamido-2-deoxy-a-D-glucuronic acidGenerator
UDP-N-2-Acetamido-2-deoxy-alpha-D-glucuronic acidGenerator
UDP-N-2-Acetamido-2-deoxy-α-D-glucuronateGenerator
UDP-N-2-Acetamido-2-deoxy-α-D-glucuronic acidGenerator
UDP-2-Acetamido-2-deoxy-a-D-glucuronate(3-)Generator
UDP-2-Acetamido-2-deoxy-a-D-glucuronic acid(3-)Generator
UDP-2-Acetamido-2-deoxy-alpha-D-glucuronic acid(3-)Generator
UDP-2-Acetamido-2-deoxy-α-D-glucuronate(3-)Generator
UDP-2-Acetamido-2-deoxy-α-D-glucuronic acid(3-)Generator
Molecular FormulaC17H22N3O18P2
Average Mass618.315
Monoisotopic Mass618.039005616
IUPAC Name(2S,3S,4R,5R,6R)-6-({[({[(2R,3S,4R,5R)-3,4-dihydroxy-5-(4-oxido-2-oxo-1,2-dihydropyrimidin-1-yl)oxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)-3,4-dihydroxy-5-[(1-oxidoethylidene)amino]oxane-2-carboxylate
Traditional Name(2S,3S,4R,5R,6R)-6-[({[(2R,3S,4R,5R)-3,4-dihydroxy-5-(4-oxido-2-oxopyrimidin-1-yl)oxolan-2-yl]methoxy(hydroxy)phosphoryl}oxy(hydroxy)phosphoryl)oxy]-3,4-dihydroxy-5-[(1-oxidoethylidene)amino]oxane-2-carboxylate
CAS Registry NumberNot Available
SMILES
[H][C@]1(COP(O)(=O)OP(O)(=O)O[C@@]2([H])O[C@]([H])(C([O-])=O)[C@@]([H])(O)[C@]([H])(O)[C@@]2([H])N=C(C)[O-])O[C@@]([H])(N2C=CC([O-])=NC2=O)[C@]([H])(O)[C@]1([H])O
InChI Identifier
InChI=1S/C17H25N3O18P2/c1-5(21)18-8-10(24)11(25)13(15(27)28)36-16(8)37-40(32,33)38-39(30,31)34-4-6-9(23)12(26)14(35-6)20-3-2-7(22)19-17(20)29/h2-3,6,8-14,16,23-26H,4H2,1H3,(H,18,21)(H,27,28)(H,30,31)(H,32,33)(H,19,22,29)/p-3/t6-,8-,9-,10-,11+,12-,13+,14-,16-/m1/s1
InChI KeyDZOGQXKQLXAPND-HHKCBAECSA-K