input word = C00036495

Metabolite InformationStructural formula
Name 2'-Hydroxygenistein 7,4'-O-diglucoside
Formula C27H30O16
Mw 610.15338491
CAS RN 147879-69-4
C_ID C00036495 ,
InChIKey DGEFYIULIWNIBU-YYJJPAPLNA-N
InChICode InChI=1S/C27H30O16/c28-6-16-20(33)22(35)24(37)26(42-16)40-9-1-2-11(13(30)3-9)12-8-39-15-5-10(4-14(31)18(15)19(12)32)41-27-25(38)23(36)21(34)17(7-29)43-27/h1-5,8,16-17,20-31,33-38H,6-7H2/t16-,17-,20-,21-,22+,23+,24-,25-,26-,27-/m1/s1
SMILES c1(cc(c2c(c1)occ(c2=O)c1c(cc(cc1)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)O)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
PlantaeFabaceaeLupinus albus L. Ref.
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