CHEBI:9941 - velloquercetin

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name velloquercetin
ChEBI ID CHEBI:9941
Definition An extended flavonoid that consists of quercetin substituted by a 2-isopropenyldihydrofuran ring across positions 6 and 7.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C20H16O7
Net Charge 0
Average Mass 368.33680
Monoisotopic Mass 368.08960
InChI InChI=1S/C20H16O7/c1-8(2)13-6-10-14(26-13)7-15-16(17(10)23)18(24)19(25)20(27-15)9-3-4-11(21)12(22)5-9/h3-5,7,13,21-23,25H,1,6H2,2H3
InChIKey YFDRNZOCVRPNBL-UHFFFAOYSA-N
SMILES CC(=C)C1Cc2c(O1)cc1oc(-c3ccc(O)c(O)c3)c(O)c(=O)c1c2O
Roles Classification
Biological Role(s): plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing velloquercetin (CHEBI:9941) has functional parent quercetin (CHEBI:16243)
velloquercetin (CHEBI:9941) has role metabolite (CHEBI:25212)
velloquercetin (CHEBI:9941) has role plant metabolite (CHEBI:76924)
velloquercetin (CHEBI:9941) is a extended flavonoid (CHEBI:71037)
velloquercetin (CHEBI:9941) is a flavonols (CHEBI:28802)
velloquercetin (CHEBI:9941) is a furochromene (CHEBI:39432)
velloquercetin (CHEBI:9941) is a tetrahydroxyflavone (CHEBI:38684)
IUPAC Name
7-(3,4-dihydroxyphenyl)-4,6-dihydroxy-2-(prop-1-en-2-yl)-2,3-dihydro-5H-furo[3,2-g]chromen-5-one
Synonym Source
2ʼʼ-isopropenyldihydrofurano(4ʼʼ,5ʼʼ:6,7)quercetin ChEBI
Manual Xrefs Databases
C00005099 KNApSAcK
C10194 KEGG COMPOUND
LMPK12112283 LIPID MAPS
View more database links
Registry Numbers Types Sources
139955-63-8 CAS Registry Number KEGG COMPOUND
5360077 Reaxys Registry Number Reaxys
Last Modified
28 July 2014
General Comment
2013-11-25 Phytochemistry (1992), 31(1), 305 - 308.