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CHEBI:42658 - 4-O-METHYL-BETA-D-GLUCURONIC ACID

Default Structure
ChEBI IDCHEBI:42658
ChEBI Name4-O-METHYL-BETA-D-GLUCURONIC ACID
Stars
Last Modified16 May 2008
DownloadsMolfile
FormulaC7H12O7
Net Charge0
Average Mass208.166
Monoisotopic Mass208.05830
SMILES[H]OC(=O)[C@@]1([H])O[C@@]([H])(O[H])[C@]([H])(O[H])[C@@]([H])(O[H])[C@]1([H])OC([H])([H])[H]
InChIInChI=1S/C7H12O7/c1-13-4-2(8)3(9)7(12)14-5(4)6(10)11/h2-5,7-9,12H,1H3,(H,10,11)/t2-,3-,4+,5+,7-/m1/s1
InChIKeyWGLLPAPKWFDHHV-RLZVPWTLSA-N
ChEBI Ontology
Outgoing Relation(s)
4-O-METHYL-BETA-D-GLUCURONIC ACID (CHEBI:42658) is a unclassifieds (CHEBI:27189)
Synonyms  Source
4-O-methyl-beta-D-glucopyranuronic acidPDBeChem
4-O-METHYL-BETA-D-GLUCURONIC ACIDPDBeChem
Manual XrefsDatabases
GCWPDBeChem