input word = C00010154

Metabolite InformationStructural formula
Name Daidzein 7-O-glucoside-4'-O-apioside
Formula C26H28O13
Mw 548.15299098
CAS RN 108069-01-8
C_ID C00010154 ,
InChIKey CLSSVAPYJUYEAY-IKPODFJPNA-N
InChICode InChI=1S/C26H28O13/c27-8-18-20(30)21(31)22(32)24(39-18)38-14-5-6-15-17(7-14)35-9-16(19(15)29)12-1-3-13(4-2-12)37-25-23(33)26(34,10-28)11-36-25/h1-7,9,18,20-25,27-28,30-34H,8,10-11H2/t18-,20+,21-,22+,23+,24+,25-,26+/m0/s1
SMILES O=c1c(-c2ccc(O[C@@H]3OCC(O)(CO)[C@@H]3O)cc2)coc2cc(O[C@@H]3OC(CO)[C@@H](O)[C@H](O)C3O)ccc12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeNeorautanenia amboensis Ref.
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