input word = C00005166

Metabolite InformationStructural formula
Name Kaempferol 3-O-gentiobioside
Kaempferol 3-gentiobioside
Formula C27H30O16
Mw 610.15338491
CAS RN 22149-35-5
C_ID C00005166 ,
InChIKey BITPRCODIALMOV-MAUJFVQSNA-N
InChICode InChI=1S/C27H30O16/c28-7-14-17(32)20(35)22(37)26(41-14)39-8-15-18(33)21(36)23(38)27(42-15)43-25-19(34)16-12(31)5-11(30)6-13(16)40-24(25)9-1-3-10(29)4-2-9/h1-6,14-15,17-18,20-23,26-33,35-38H,7-8H2/t14-,15+,17+,18+,20+,21+,22-,23+,26+,27-/m0/s1
SMILES c1(cc(c2c(c1)oc(c(c2=O)O[C@H]1[C@@H]([C@@H]([C@@H]([C@H](O1)CO[C@H]1[C@H]([C@@H]([C@@H]([C@@H](O1)CO)O)O)O)O)O)O)c1ccc(cc1)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAdoxaceaeViburnum dilatum Ref.
PlantaeFabaceaeGlycine max Ref.
PlantaeFabaceaeStyphnolobium japonicum Ref.
PlantaeFumariaceaeFumaria parviflora Ref.
PlantaePapaveraceaeMeconopsis betonicifolia Ref.
PlantaePapaveraceaeMeconopsis grandis Ref.
PlantaePapaveraceaeMeconopsis horridula Ref.
PlantaePrimulaceaePrimula sinensis Ref.
PlantaeRosaceaeSorbus pendula Ref.
PlantaeZygophyllaceaeTribulus longipetalus Ref.
PlantaeZygophyllaceaeTribulus pentandrus Ref.
PlantaeZygophyllaceaeTribulus terrestris Ref.
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OrganismTribulus longipetalus
ReferenceHarborne, The Handbook of Natural Flavonoids, 1, (1999), 297.Flavonol O-glycosides

Harborne,Biochem.J.,78,(1961),298

Wagner,Chem.Ber.,101,(1968),3419