input word = C00005254

Metabolite InformationStructural formula
Name Kaempferol 3-isorhamninoside-7-rhamnoside
Formula C39H50O23
Mw 886.27428791
CAS RN 123479-26-5
C_ID C00005254 ,
InChIKey MFMPPIGSYYTBKG-BUNSSRQVNA-N
InChICode InChI=1S/C39H50O23/c1-11-21(42)25(46)29(50)37(55-11)58-16-8-17(41)20-18(9-16)59-34(14-4-6-15(40)7-5-14)35(24(20)45)62-39-31(52)27(48)23(44)19(60-39)10-54-36-32(53)28(49)33(13(3)57-36)61-38-30(51)26(47)22(43)12(2)56-38/h4-9,11-13,19,21-23,25-33,36-44,46-53H,10H2,1-3H3/t11-,12+,13-,19-,21-,22-,23-,25-,26-,27+,28+,29+,30+,31-,32-,33?,36+,37-,38-,39-/m0/s1
SMILES CC1O[C@@H](Oc2cc(O)c3c(=O)c(O[C@@H]4OC(CO[C@@H]5OC(C)[C@H](O[C@@H]6OC(C)[C@H](O)[C@H](O)C6O)[C@H](O)C5O)[C@H](O)C(O)C4O)c(-c4ccc(O)cc4)oc3c2)C(O)[C@@H](O)[C@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeVigna luteola Ref.
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OrganismVigna luteola
ReferenceHarborne, The Handbook of Natural Flavonoids, 1, (1999), 297.Flavonol O-glycosides

Pomilio,J.Nat.Prod.,52,(1989),511

Zallocchi,Phytochem.,37,(1994),449