CHEBI:28152 - 3-hydroxy-5-methoxy-6-prenylstilbene-2-carboxylic acid

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 3-hydroxy-5-methoxy-6-prenylstilbene-2-carboxylic acid
ChEBI ID CHEBI:28152
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:20050, CHEBI:1528
Supplier Information
Download Molfile XML SDF
Formula C21H22O4
Net Charge 0
Average Mass 338.39698
Monoisotopic Mass 338.15181
InChI InChI=1S/C21H22O4/c1-14(2)9-11-16-17(12-10-15-7-5-4-6-8-15)20(21(23)24)18(22)13-19(16)25-3/h4-10,12-13,22H,11H2,1-3H3,(H,23,24)/b12-10+
InChIKey DFMCTODOEICLEB-ZRDIBKRKSA-N
SMILES COc1cc(O)c(C(O)=O)c(\C=C\c2ccccc2)c1CC=C(C)C
ChEBI Ontology
Outgoing 3-hydroxy-5-methoxy-6-prenylstilbene-2-carboxylic acid (CHEBI:28152) is a stilbenoid (CHEBI:26776)
IUPAC Name
6-hydroxy-4-methoxy-3-(3-methylbut-2-en-1-yl)-2-[(E)-2-phenylethenyl]benzoic acid
Synonyms Sources
3-Hydroxy-5-methoxy-6-prenylstilbene-2-carboxylic acid KEGG COMPOUND
6-hydroxy-4-methoxy-3-(3-methylbut-2-en-1-yl)-2-[(E)-2-phenylvinyl]benzoic acid ChEBI
Manual Xrefs Databases
C00002885 KNApSAcK
C10264 KEGG COMPOUND
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Registry Numbers Types Sources
6739908 Beilstein Registry Number Beilstein
87402-83-3 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014