input word = C00001748

Metabolite InformationStructural formula
Name Mesembrenone
Formula C17H21NO3
Mw 287.15214354
CAS RN 80287-15-6
C_ID C00001748 ,
InChIKey HDNHBCSWFYFPAN-RXQGYGPJNA-N
InChICode InChI=1S/C17H21NO3/c1-18-9-8-17(7-6-13(19)11-16(17)18)12-4-5-14(20-2)15(10-12)21-3/h4-7,10,16H,8-9,11H2,1-3H3/t16-,17-/m0/s1
SMILES COc1ccc([C@@]23C=CC(=O)C[C@@H]2N(C)CC3)cc1OC
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr
Organism
Kingdom Family Species Reference
PlantaeAizoaceaeMesembryanthemum anatomicum Ref.
PlantaeAizoaceaeMesembryanthemum expansum Ref.
PlantaeAizoaceaeMesembryanthemum tortuosum Ref.
PlantaeAizoaceaeSceletium anatomicum Ref.
PlantaeAizoaceaeSceletium expansum Ref.
PlantaeAizoaceaeSceletium tortuosum Ref.
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OrganismMesembryanthemum expansum
ReferenceSun, et al., Brief Handbook of Natural Active Compounds, Medicinal Science and Technology Press of China, Beijing, (1998)