CHEBI:28018 - 3,3',4',5,7-pentahydroxy-8-methoxyflavone

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 3,3',4',5,7-pentahydroxy-8-methoxyflavone
ChEBI ID CHEBI:28018
Definition A monomethoxyflavone that is the 8-O-methyl derivative of gossypetin .
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:11683, CHEBI:1363, CHEBI:19861
Supplier Information
Download Molfile XML SDF
Formula C16H12O8
Net Charge 0
Average Mass 332.26168
Monoisotopic Mass 332.05322
InChI InChI=1S/C16H12O8/c1-23-15-10(20)5-9(19)11-12(21)13(22)14(24-16(11)15)6-2-3-7(17)8(18)4-6/h2-5,17-20,22H,1H3
InChIKey ZASFHSAGASJGRN-UHFFFAOYSA-N
SMILES COc1c(O)cc(O)c2c1oc(-c1ccc(O)c(O)c1)c(O)c2=O
ChEBI Ontology
Outgoing 3,3',4',5,7-pentahydroxy-8-methoxyflavone (CHEBI:28018) has functional parent gossypetin (CHEBI:16400)
3,3',4',5,7-pentahydroxy-8-methoxyflavone (CHEBI:28018) is a flavonols (CHEBI:28802)
3,3',4',5,7-pentahydroxy-8-methoxyflavone (CHEBI:28018) is a monomethoxyflavone (CHEBI:25401)
3,3',4',5,7-pentahydroxy-8-methoxyflavone (CHEBI:28018) is a pentahydroxyflavone (CHEBI:25883)
3,3',4',5,7-pentahydroxy-8-methoxyflavone (CHEBI:28018) is conjugate acid of 3',4',5,7-pentahydroxy-8-methoxyflavon-3-olate (CHEBI:58544)
Incoming 3',4',5,7-pentahydroxy-8-methoxyflavon-3-olate (CHEBI:58544) is conjugate base of 3,3',4',5,7-pentahydroxy-8-methoxyflavone (CHEBI:28018)
IUPAC Name
2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-8-methoxy-4H-chromen-4-one
Synonyms Sources
3,3',4',5,7-pentahydroxy-8-methoxyflavone ChEBI
3,3',4',5,7-Pentahydroxy-8-methoxyflavone KEGG COMPOUND
8-methoxyquercetin ChEBI
corniculatusin KEGG COMPOUND
Manual Xrefs Databases
33457-PENTAHYDROXY-8-METHOXYFLAVON MetaCyc
C00004724 KNApSAcK
C04527 KEGG COMPOUND
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Last Modified
28 July 2014