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CHEBI:181072 - D7-Mesembrenone

ChEBI IDCHEBI:181072
ChEBI NameD7-Mesembrenone
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SubmitterMetaboLights
DownloadsMolfile
FormulaC17H21NO3
Net Charge0
Average Mass287.359
Monoisotopic Mass287.15214
SMILESCOc1ccc(C23CCC(=O)C=C2N(C)CC3)cc1OC
InChIInChI=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/h4-5,10-11H,6-9H2,1-3H3
InChIKeyXPUOZJJNPJXFTD-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
D7-Mesembrenone (CHEBI:181072) is a pyrrolidines (CHEBI:38260)
IUPAC Name 
3a-(3,4-dimethoxyphenyl)-1-methyl-2,3,4,5-tetrahydroindol-6-one
Manual XrefsDatabases
9252185ChemSpider