input word = C00019758

Metabolite InformationStructural formula
Name Glycitein 7-O-(6''-succinylglucoside)
7,4'-Dihydroxy-6-methoxyisoflavone 7-O-(6''-succinylglucoside)
Formula C26H26O13
Mw 546.13734092
CAS RN 163310-44-9
C_ID C00019758 ,
InChIKey GVXJPLOLMFXZFW-YTUDVUSINA-N
InChICode InChI=1S/C26H26O13/c1-35-17-8-14-16(36-10-15(22(14)31)12-2-4-13(27)5-3-12)9-18(17)38-26-25(34)24(33)23(32)19(39-26)11-37-21(30)7-6-20(28)29/h2-5,8-10,19,23-27,32-34H,6-7,11H2,1H3,(H,28,29)/t19-,23-,24+,25-,26-/m1/s1
SMILES c1(c(cc2c(c1)occ(c2=O)c1ccc(cc1)O)OC)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)COC(=O)CCC(=O)O)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
BacteriaBacillaceaeBacillus subtilis Ref.
PlantaeFabaceaeMedicago sativa Ref.
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