Vanillic acid-4-O-glucuronide (CHEBI:89555)

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CHEBI:89555 - Vanillic acid-4-O-glucuronide

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ChEBI ID	CHEBI:89555
ChEBI Name	Vanillic acid-4-O-glucuronide
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Downloads	Molfile

Formula	C15H18O9
Net Charge	0
Average Mass	342.300
Monoisotopic Mass	342.09508
SMILES	COc1cc(C(=O)O)ccc1O[C@@H]1O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]1C
InChI	InChI=1S/C15H18O9/c1-6-10(16)11(17)12(14(20)21)24-15(6)23-8-4-3-7(13(18)19)5-9(8)22-2/h3-6,10-12,15-17H,1-2H3,(H,18,19)(H,20,21)/t6-,10-,11+,12+,15-/m1/s1
InChIKey	MBNPZIKKKDDLLL-QGZCQISNSA-N

Species of Metabolite	Component	Source	Comments
Homo sapiens (ncbitaxon:9606)	urine (BTO:0001419)	PubMed (22827565)

Roles Classification

astringent A compound that causes the contraction of body tissues, typically used to reduce bleeding from minor abrasions.

ChEBI Ontology

Outgoing Relation(s)
	Vanillic acid-4-O-glucuronide (CHEBI:89555) is a tannin (CHEBI:26848)

Synonym	Source
(2S,3S,4R,5R,6S)-6-(4-carboxy-2-methoxyphenoxy)-3,4-dihydroxy-5-methyloxane-2-carboxylic acid	HMDB

Manual Xrefs	Databases
HMDB0060024	HMDB

Citations