3-hydroxy-3-(4'-hydroxy-3'-methoxyphenyl)propionic acid (CHEBI:177935)

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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-3-(4'-hydroxy-3'-methoxyphenyl)propionic acid

ChEBI ID	CHEBI:177935

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C10H12O5

Net Charge

Average Mass

212.201

Monoisotopic Mass

212.06847

InChI

InChI=1S/C10H12O5/c1-15-9-4-6(2-3-7(9)11)8(12)5-10(13)14/h2-4,8,11-12H,5H2,1H3,(H,13,14)

InChIKey

ABTZMSOARGMKMK-UHFFFAOYSA-N

SMILES

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

Metabolite of Species	Details
Bombyx mori (NCBI:txid7091)	Found in hemolymph (BTO:0000572).

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-hydroxy-3-(4'-hydroxy-3'-methoxyphenyl)propionic acid (CHEBI:177935) is a benzenes (CHEBI:22712) 3-hydroxy-3-(4'-hydroxy-3'-methoxyphenyl)propionic acid (CHEBI:177935) is a monocarboxylic acid (CHEBI:25384) 3-hydroxy-3-(4'-hydroxy-3'-methoxyphenyl)propionic acid (CHEBI:177935) is conjugate acid of 3-hydroxy-3-(4-hydroxy-3-methoxyphenyl)propanoate (CHEBI:229973)

Incoming	3-hydroxy-3-(4-hydroxy-3-methoxyphenyl)propanoate (CHEBI:229973) is conjugate base of 3-hydroxy-3-(4'-hydroxy-3'-methoxyphenyl)propionic acid (CHEBI:177935)

IUPAC Name

3-hydroxy-3-(4-hydroxy-3-methoxyphenyl)propanoic acid