input word = C00019726

Metabolite InformationStructural formula
Name (3R)-7,2'-Dihydroxy-3',4'-dimethoxyisoflavan 7,2'-O-diglucoside
Formula C29H38O15
Mw 626.22107055
CAS RN 137217-84-6
C_ID C00019726 ,
InChIKey NHOPAJCVMDIGBN-ZQMSQZAENA-N
InChICode InChI=1S/C29H38O15/c1-38-16-6-5-15(26(27(16)39-2)44-29-25(37)23(35)21(33)19(10-31)43-29)13-7-12-3-4-14(8-17(12)40-11-13)41-28-24(36)22(34)20(32)18(9-30)42-28/h3-6,8,13,18-25,28-37H,7,9-11H2,1-2H3/t13-,18-,19+,20-,21-,22-,23-,24+,25+,28+,29-/m0/s1
SMILES COc1ccc([C@@H]2COc3cc(O[C@@H]4OC(CO)[C@@H](O)[C@H](O)C4O)ccc3C2)c(O[C@@H]2OC(CO)[C@@H](O)[C@H](O)C2O)c1OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeAstragalus mongholicus Ref.
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