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CHEBI:145605 - methyl β-D-glucopyranuronate

ChEBI IDCHEBI:145605
ChEBI Namemethyl β-D-glucopyranuronate
Stars
ASCII Namemethyl beta-D-glucopyranuronate
DefinitionA methyl D-glucopyranuronate in which the carbon bearing the anomeric hydroxy group has β configuration.
Last Modified23 June 2020
SubmitterGareth Owen
DownloadsMolfile
FormulaC7H12O7
Net Charge0
Average Mass208.166
Monoisotopic Mass208.05830
SMILESCOC(=O)[C@H]1O[C@@H](O)[C@H](O)[C@@H](O)[C@@H]1O
WURCSWURCS=2.0/1,1,0/[a2122A-1b_1-5_6*OC]/1/
InChIInChI=1S/C7H12O7/c1-13-7(12)5-3(9)2(8)4(10)6(11)14-5/h2-6,8-11H,1H3/t2-,3-,4+,5-,6+/m0/s1
InChIKeyDICCNWCUKCYGNF-MDMQIMBFSA-N
ChEBI Ontology
Outgoing Relation(s)
methyl β-D-glucopyranuronate (CHEBI:145605) has functional parent β-D-glucuronic acid (CHEBI:28860)
methyl β-D-glucopyranuronate (CHEBI:145605) is a methyl D-glucopyranuronate (CHEBI:155901)
IUPAC Names 
methyl β-D-glucopyranuronate
β-D-GlcpA6Me
Synonyms  Source
methyl (2S,3S,4S,5R,6R)-3,4,5,6-tetrahydroxyoxane-2-carboxylateIUPAC
β-D-glucopyranuronic acid methyl esterChEBI
β-D-glucuronic acid methyl esterChEBI
methyl-β-D-glucopyranosiduronic acidMetaCyc
1-O-methyl-β-D-glucuronic acidMetaCyc
methyl-β-D-glucuronideMetaCyc
Manual XrefsDatabases
G32430MQGlyTouCan
CPD-3611MetaCyc
US5510243Patent
G32430MQGlyGen
Citations