input word = C00053995

Metabolite InformationStructural formula
Name Aegle marmelos Alkaloid C
Formula C23H27NO3
Mw 365.19909374
CAS RN 70546-92-8
C_ID C00053995
InChIKey MLCNANOYWKNAAF-NTEUORMPSA-N
InChICode InChI=1S/C23H27NO3/c1-18(2)15-16-27-21-12-10-20(11-13-21)22(26-3)17-24-23(25)14-9-19-7-5-4-6-8-19/h4-15,22H,16-17H2,1-3H3,(H,24,25)/b14-9+
SMILES COC(CNC(=O)/C=C/c1ccccc1)c1ccc(OCC=C(C)C)cc1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRutaceaeAegle marmelos Ref.
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