input word = C00005261

Metabolite InformationStructural formula
Name Kaempferol 3-galactosyl-(1->6)-glucoside-7-rhamnosyl-(1->3)-rhamnoside
Formula C39H50O24
Mw 902.26920253
CAS RN 81944-31-2
C_ID C00005261 ,
InChIKey OVHQWOXKMOVDJP-HVDFELGMNA-N
InChICode InChI=1S/C39H50O24/c1-11-21(43)26(48)30(52)37(56-11)62-34-22(44)12(2)57-39(32(34)54)58-15-7-16(42)20-17(8-15)59-33(13-3-5-14(41)6-4-13)35(25(20)47)63-38-31(53)28(50)24(46)19(61-38)10-55-36-29(51)27(49)23(45)18(9-40)60-36/h3-8,11-12,18-19,21-24,26-32,34,36-46,48-54H,9-10H2,1-2H3/t11-,12-,18+,19+,21-,22-,23-,24+,26+,27-,28-,29+,30+,31+,32-,34+,36+,37-,38-,39-/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[C@@H]1O[C@H]([C@@H]([C@H]([C@@H]1O)O[C@@H]1O[C@H]([C@@H]([C@H]([C@H]1O)O)O)C)O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeAcacia trachyphloia Ref.
PlantaeFabaceaeAcacia verniciflua Ref.
PlantaeFabaceaeMelilotus alba Ref.
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OrganismAcacia trachyphloia
ReferenceTindale,Phytochem.,8,(1969),1713