CHEBI:147317 - 7-O-methoxy gossypetin 3-O-rutinoside

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name 7-O-methoxy gossypetin 3-O-rutinoside
ChEBI ID CHEBI:147317
Stars This entity has been manually annotated by a third party.
Submitter Mark Williams
Supplier Information
Download Molfile XML SDF
Formula C28H32O17
Net Charge 0
Average Mass 640.547
Monoisotopic Mass 640.16395
InChI InChI=1S/C28H32O17/c1-8-16(32)20(36)22(38)27(42-8)41-7-14-17(33)21(37)23(39)28(43-14)45-26-19(35)15-12(31)6-13(40-2)18(34)25(15)44-24(26)9-3-4-10(29)11(30)5-9/h3-6,8,14,16-17,20-23,27-34,36-39H,7H2,1-2H3/t8-,14+,16-,17+,20+,21-,22+,23+,27+,28-/m0/s1
InChIKey AWDJLPGVCMQRAF-IHXONYQQSA-N
SMILES C=1C(=C(C=2OC(=C(C(C2C1O)=O)O[C@@H]3O[C@@H]([C@H]([C@@H]([C@H]3O)O)O)CO[C@H]4[C@@H]([C@@H]([C@H]([C@@H](O4)C)O)O)O)C5=CC=C(C(=C5)O)O)O)OC
Metabolite of Species Details
Smallanthus sonchifolius (NCBI:txid185202) Found in leaf lamina (BTO:0000719). See: PubMed
ChEBI Ontology
Outgoing 7-O-methoxy gossypetin 3-O-rutinoside (CHEBI:147317) is a disaccharide derivative (CHEBI:63353)
7-O-methoxy gossypetin 3-O-rutinoside (CHEBI:147317) is a glycosyloxyflavone (CHEBI:50018)
7-O-methoxy gossypetin 3-O-rutinoside (CHEBI:147317) is a monomethoxyflavone (CHEBI:25401)
7-O-methoxy gossypetin 3-O-rutinoside (CHEBI:147317) is a tetrahydroxyflavone (CHEBI:38684)