2-Hydroxy-4-methoxy-3-(3-methyl-2-butenyl)-6-(2-phenylethenyl)benzoic acid (CHEBI:174548)

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

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	2-Hydroxy-4-methoxy-3-(3-methyl-2-butenyl)-6-(2-phenylethenyl)benzoic acid

ChEBI ID	CHEBI:174548

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C21H22O4

Net Charge

Average Mass

338.403

Monoisotopic Mass

338.15181

InChI

InChI=1S/C21H22O4/c1-14(2)9-12-17-18(25-3)13-16(19(20(17)22)21(23)24)11-10-15-7-5-4-6-8-15/h4-11,13,22H,12H2,1-3H3,(H,23,24)/b11-10+

InChIKey

XPDYDSQPCFQSLH-ZHACJKMWSA-N

SMILES

O(C1=C(CC=C(C)C)C(O)=C(C(=C1)/C=C/C2=CC=CC=C2)C(O)=O)C

ChEBI Ontology
Outgoing	2-Hydroxy-4-methoxy-3-(3-methyl-2-butenyl)-6-(2-phenylethenyl)benzoic acid (CHEBI:174548) is a stilbenoid (CHEBI:26776)

IUPAC Name

2-hydroxy-4-methoxy-3-(3-methylbut-2-enyl)-6-[(E)-2-phenylethenyl]benzoic acid