input word = C00026481

Metabolite InformationStructural formula
Name Semecarpifoline
Formula C13H15NO4
Mw 249.10010798
CAS RN 366789-86-8
C_ID C00026481 ,
InChIKey WBHOECNXRGZKAH-UHFFFAOYSA-N
InChICode InChI=1S/C13H15NO4/c1-16-7-10-12(18-3)9-5-4-8(17-2)6-11(9)14-13(10)15/h4-6H,7H2,1-3H3,(H,14,15)
SMILES COc1ccc2c(c1)[nH]c(=O)c(c2OC)COC
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr
Organism
Kingdom Family Species Reference
PlantaeRutaceaeMelicope semecarpifolia Ref.
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OrganismMelicope semecarpifolia
ReferenceMichael,Nat.Prod.Rep.,20,(2003),476