input word = C00013743

Metabolite InformationStructural formula
Name Kaempferol 7,4'-diglucoside
7-(beta-D-Glucopyranosyloxy)-2-[4-(beta-D-glucopyranosyloxy)phenyl]-3,5-dihydroxy-4H-1-benzopyran-4-one
Formula C27H30O16
Mw 610.15338491
CAS RN 87338-64-5
C_ID C00013743 ,
InChIKey HFNAWTPFBXBKFK-YSOSRWOWNA-N
InChICode InChI=1S/C27H30O16/c28-7-14-17(31)20(34)23(37)26(42-14)39-10-3-1-9(2-4-10)25-22(36)19(33)16-12(30)5-11(6-13(16)41-25)40-27-24(38)21(35)18(32)15(8-29)43-27/h1-6,14-15,17-18,20-21,23-24,26-32,34-38H,7-8H2/t14-,15+,17+,18+,20-,21-,23+,24+,26+,27+/m0/s1
SMILES c1c(ccc(c1)O[C@H]1[C@@H]([C@H]([C@@H]([C@@H](O1)CO)O)O)O)c1oc2c(c(=O)c1O)c(cc(c2)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeCassia javanica Ref.
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