input word = C00054250

Metabolite InformationStructural formula
Name N-Acetoxymethylflindersine
Formula C17H17NO4
Mw 299.11575804
CAS RN 149998-45-8
C_ID C00054250
InChIKey JXPDGNCKRXEJET-UHFFFAOYSA-N
InChICode InChI=1S/C17H17NO4/c1-11(19)21-10-18-14-7-5-4-6-12(14)15-13(16(18)20)8-9-17(2,3)22-15/h4-9H,10H2,1-3H3
SMILES CC(C=C1)(C)OC2=C1C(N(COC(C)=O)C3=C2C=CC=C3)=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRutaceaeZanthoxylum schinifolium Ref.
PlantaeRutaceaeZanthoxylum simulans Ref.
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OrganismZanthoxylum simulans
ReferenceBrown, R.F.C. et al., Aust. J. Chem., 1954, 7, 348 (isol, uv, struct)