input word = C00010109

Metabolite InformationStructural formula
Name Genistein 7,4'-bis(O-glucosylapioside)
Sarothamnoside
Formula C37H46O23
Mw 858.24298778
CAS RN 78693-95-5
C_ID C00010109 ,
InChIKey LOSLKNDENQPHQW-YPELIJIRNA-N
InChICode InChI=1S/C37H46O23/c38-7-20-24(42)26(44)28(46)32(59-20)53-10-36(50)12-55-34(30(36)48)57-15-3-1-14(2-4-15)17-9-52-19-6-16(5-18(40)22(19)23(17)41)58-35-31(49)37(51,13-56-35)11-54-33-29(47)27(45)25(43)21(8-39)60-33/h1-6,9,20-21,24-35,38-40,42-51H,7-8,10-13H2/t20-,21-,24-,25+,26+,27+,28-,29-,30-,31+,32-,33+,34+,35+,36-,37+/m1/s1
SMILES O(c1cc2c(c(=O)c(co2)c2ccc(cc2)O[C@H]2[C@H]([C@](CO2)(CO[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)O)O)c(c1)O)[C@H]1[C@@H]([C@@](CO1)(CO[C@H]1O[C@@H]([C@@H]([C@@H]([C@H]1O)O)O)CO)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeCytisus scoparius Ref.
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