input word = C00059429

Metabolite InformationStructural formula
Name Citrusin C malonate
Formula C19H24O10
Mw 412.13694699
CAS RN 1208322-61-5
C_ID C00059429
InChIKey KVHXUOROMTVOSX-LQDZTQBFSA-N
InChICode InChI=1S/C19H24O10/c1-3-4-10-5-6-11(12(7-10)26-2)28-19-18(25)17(24)16(23)13(29-19)9-27-15(22)8-14(20)21/h3,5-7,13,16-19,23-25H,1,4,8-9H2,2H3,(H,20,21)/t13-,16-,17+,18-,19-/m1/s1
SMILES C=CCc1ccc(OC2OC(COC(=O)CC(=O)O)C(O)C(O)C2O)c(OC)c1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeVicia faba Ref.
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