3-Hydroxy-4-methoxymandelate (CHEBI:173981)

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.

ChEBI Name	3-Hydroxy-4-methoxymandelate

ChEBI ID	CHEBI:173981

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

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Formula

C9H10O5

Net Charge

Average Mass

198.174

Monoisotopic Mass

198.05282

InChI

InChI=1S/C9H10O5/c1-14-7-3-2-5(4-6(7)10)8(11)9(12)13/h2-4,8,10-11H,1H3,(H,12,13)/t8-/m1/s1

InChIKey

PXMUSCHKJYFZFD-MRVPVSSYSA-N

SMILES

O[C@H](C1=CC(O)=C(OC)C=C1)C(O)=O

ChEBI Ontology
Outgoing	3-Hydroxy-4-methoxymandelate (CHEBI:173981) is a methoxybenzenes (CHEBI:51683) 3-Hydroxy-4-methoxymandelate (CHEBI:173981) is a phenols (CHEBI:33853)

IUPAC Name

(2R)-2-hydroxy-2-(3-hydroxy-4-methoxyphenyl)acetic acid