input word = C00004063

Metabolite InformationStructural formula
Name Desmodol
Formula C21H18O6
Mw 366.11033831
CAS RN 68349-71-3
C_ID C00004063 ,
InChIKey RYSJCVDFCLGDMM-UHFFFAOYSA-N
InChICode InChI=1S/C21H18O6/c1-10-18(25)17-15(24)9-16(11-4-5-13(22)14(23)8-11)26-20(17)12-6-7-21(2,3)27-19(10)12/h4-9,22-23,25H,1-3H3
SMILES c12c(c(c3c(c1C=CC(O2)(C)C)oc(cc3=O)c1ccc(c(c1)O)O)O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeDesmodium caudatum Ref.
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