CHEBI:31435 - Coumeroic acid

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Coumeroic acid
ChEBI ID CHEBI:31435
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C17H14N2O7
Net Charge 0
Average Mass 358.303
Monoisotopic Mass 358.08010
InChI InChI=1S/C17H14N2O7/c1-6-9(16(23)24)5-18-11(6)15(22)19-12-13(21)8-3-4-10(20)7(2)14(8)26-17(12)25/h3-5,18,20-21H,1-2H3,(H,19,22)(H,23,24)
InChIKey DBCRBUVJYHSJEQ-UHFFFAOYSA-N
SMILES Cc1c(c[nH]c1C(=O)Nc1c(O)c2ccc(O)c(C)c2oc1=O)C(O)=O
ChEBI Ontology
Outgoing Coumeroic acid (CHEBI:31435) is a hydroxycoumarin (CHEBI:37912)
Synonym Source
Coumeroic acid KEGG COMPOUND
Manual Xref Database
C12478 KEGG COMPOUND
View more database links
Last Modified
28 July 2014