input word = C00019136

Metabolite InformationStructural formula
Name 5,7,4'-Trihydroxyisoflavone 7-O-glucoside-4'-O-(2''-rhamnosylglucoside)
Genistein 7-O-beta-D-glucopyranoside-4'-O-[(alpha-L-rhamnopyranosyl)-(1->2)-beta-D-glucopyranoside]
Formula C33H40O19
Mw 740.2163791
CAS RN 361447-29-2
C_ID C00019136 ,
InChIKey JVBBENZXDKWSEC-KXMUJTBUNA-N
InChICode InChI=1S/C33H40O19/c1-11-21(37)25(41)28(44)31(47-11)52-30-27(43)24(40)19(9-35)51-33(30)48-13-4-2-12(3-5-13)15-10-46-17-7-14(6-16(36)20(17)22(15)38)49-32-29(45)26(42)23(39)18(8-34)50-32/h2-7,10-11,18-19,21,23-37,39-45H,8-9H2,1H3/t11-,18+,19+,21-,23+,24+,25+,26-,27-,28-,29+,30+,31-,32+,33+/m0/s1
SMILES c1(cc(c2c(c1)occ(c2=O)c1ccc(cc1)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O[C@@H]1O[C@H]([C@@H]([C@H]([C@@H]1O)O)O)C)O)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeSophora japonica Ref.
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