CHEBI:66215 - 5,6,7,4'-tetrahydroxyflavonol-3-O-rutinoside

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 5,6,7,4'-tetrahydroxyflavonol-3-O-rutinoside
ChEBI ID CHEBI:66215
ChEBI ASCII Name 5,6,7,4'-tetrahydroxyflavonol-3-O-rutinoside
Definition A glycosyloxyflavone that is 3,5,6,7,4'-pentahydroxyflavonol substituted by a rutinosyl group at position 3 via a glycosidic linkage. Isolated from Daphniphyllum calycinum, it exhibits antioxidant activity.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C27H30O16
Net Charge 0
Average Mass 610.51750
Monoisotopic Mass 610.15338
InChI InChI=1S/C27H30O16/c1-8-15(30)20(35)22(37)26(40-8)39-7-13-17(32)21(36)23(38)27(42-13)43-25-19(34)14-12(6-11(29)16(31)18(14)33)41-24(25)9-2-4-10(28)5-3-9/h2-6,8,13,15,17,20-23,26-33,35-38H,7H2,1H3/t8-,13+,15-,17+,20+,21-,22+,23+,26+,27-/m0/s1
InChIKey QYRJNVCANQPMCH-QGAVNTNWSA-N
SMILES C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(oc4cc(O)c(O)c(O)c4c3=O)-c3ccc(O)cc3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O
Metabolite of Species Details
Daphniphyllum calycinum (NCBI:txid182071) Found in leaf (BTO:0000713). See: PubMed
Roles Classification
Chemical Role(s): radical scavenger
A role played by a substance that can react readily with, and thereby eliminate, radicals.
Biological Role(s): 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 5,6,7,4'-tetrahydroxyflavonol-3-O-rutinoside (CHEBI:66215) has role metabolite (CHEBI:25212)
5,6,7,4'-tetrahydroxyflavonol-3-O-rutinoside (CHEBI:66215) has role radical scavenger (CHEBI:48578)
5,6,7,4'-tetrahydroxyflavonol-3-O-rutinoside (CHEBI:66215) is a disaccharide derivative (CHEBI:63353)
5,6,7,4'-tetrahydroxyflavonol-3-O-rutinoside (CHEBI:66215) is a glycosyloxyflavone (CHEBI:50018)
5,6,7,4'-tetrahydroxyflavonol-3-O-rutinoside (CHEBI:66215) is a rutinoside (CHEBI:26587)
5,6,7,4'-tetrahydroxyflavonol-3-O-rutinoside (CHEBI:66215) is a tetrahydroxyflavone (CHEBI:38684)
IUPAC Name
5,6,7-trihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-3-yl 6-O-(6-deoxy-α-L-mannopyranosyl)-β-D-glucopyranoside
Citation Waiting for Citations Type Source
9599286 PubMed citation Europe PMC
Last Modified
11 July 2013