input word = C00059780

Metabolite InformationStructural formula
Name Glycitein 6''-O-malonylglucoside
Formula C25H24O13
Mw 532.12169086
CAS RN 137705-39-6
C_ID C00059780
InChIKey OYDNPVAEDDPNLO-XIRKIXBGSA-N
InChICode InChI=1S/C25H24O13/c1-34-16-6-13-15(35-9-14(21(13)30)11-2-4-12(26)5-3-11)7-17(16)37-25-24(33)23(32)22(31)18(38-25)10-36-20(29)8-19(27)28/h2-7,9,18,22-26,31-33H,8,10H2,1H3,(H,27,28)/t18-,22-,23+,24-,25-/m1/s1
SMILES COc1cc2c(=O)c(-c3ccc(O)cc3)coc2cc1OC1OC(COC(=O)CC(=O)O)C(O)C(O)C1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeGlycine max Ref.
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OrganismGlycine max
Referencehttps://doi.org/10.1002/j.1537-2197.1995.tb11560.x

https://doi.org/10.1093/pcp/pcx192