input word = C00019473

Metabolite InformationStructural formula
Name Maackiain 3-O-glucosyl-6''-malonate
Trifolirhizin 6'-O-malonate
Formula C25H24O13
Mw 532.12169086
CAS RN 135574-57-1
C_ID C00019473 ,
InChIKey ZHXRWFOBROFZAC-ZUTMTVEFNA-N
InChICode InChI=1S/C25H24O13/c26-19(27)6-20(28)33-8-18-21(29)22(30)23(31)25(38-18)36-10-1-2-11-14(3-10)32-7-13-12-4-16-17(35-9-34-16)5-15(12)37-24(11)13/h1-5,13,18,21-25,29-31H,6-9H2,(H,26,27)/t13-,18+,21+,22-,23+,24-,25+/m0/s1
SMILES c1(ccc2c(c1)OC[C@@H]1[C@H]2Oc2c1cc1c(c2)OCO1)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)COC(=O)CC(=O)O)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeCicer arietinum Ref.
PlantaeFabaceaeCicer judaicum Ref.
PlantaeFabaceaeSophora flavescens Ref.
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OrganismSophora flavescens
ReferenceYamamoto,Phytochem.,30,(1991),1732