3-(4-Hydroxy-3-methoxyphenyl)-2-methyllactic acid (CHEBI:174168)

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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-(4-Hydroxy-3-methoxyphenyl)-2-methyllactic acid

ChEBI ID	CHEBI:174168

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

Submitter	MetaboLights

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Download	Molfile XML SDF

Formula

C11H14O5

Net Charge

Average Mass

226.228

Monoisotopic Mass

226.08412

InChI

InChI=1S/C11H14O5/c1-11(15,10(13)14)6-7-3-4-8(12)9(5-7)16-2/h3-5,12,15H,6H2,1-2H3,(H,13,14)

InChIKey

YNNLUYGFVUZDAD-UHFFFAOYSA-N

SMILES

OC(CC1=CC(OC)=C(O)C=C1)(C)C(O)=O

Roles Classification
Chemical Role(s):	Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid )

ChEBI Ontology
Outgoing	3-(4-Hydroxy-3-methoxyphenyl)-2-methyllactic acid (CHEBI:174168) is a benzenes (CHEBI:22712) 3-(4-Hydroxy-3-methoxyphenyl)-2-methyllactic acid (CHEBI:174168) is a monocarboxylic acid (CHEBI:25384)

IUPAC Name

2-hydroxy-3-(4-hydroxy-3-methoxyphenyl)-2-methylpropanoic acid