(E)-3,4,5-Trimethoxycinnamic acid (CHEBI:228320)

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	(E)-3,4,5-Trimethoxycinnamic acid

ChEBI ID	CHEBI:228320

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C12H14O5

Net Charge

Average Mass

238.239

Monoisotopic Mass

238.08412

InChI

InChI=1S/C12H14O5/c1-15-9-6-8(4-5-11(13)14)7-10(16-2)12(9)17-3/h4-7H,1-3H3,(H,13,14)/b5-4+

InChIKey

YTFVRYKNXDADBI-SNAWJCMRSA-N

SMILES

O(C1=C(OC)C=C(C=C1OC)/C=C/C(O)=O)C

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	(E)-3,4,5-Trimethoxycinnamic acid (CHEBI:228320) is a hydroxycinnamic acid (CHEBI:24689)

IUPAC Name

(E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoic acid