Chem
J-GLOBAL ID:201607019336670169   Nikkaji number:J3.462.337F

Δ7-Mesembrenone

Δ7-メセンブレノン
Substance type:
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula: C17H21NO3
Molecular formula furigana: C17-H21-N-O3
Molecular weight: 287.359
InChI: 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/h4-5,10-11H,6-9H2,1-3H3/t17-/m1/s1
InChI key: XPUOZJJNPJXFTD-QGZVFWFLSA-N
SMILES: COc1ccc(cc1OC)[C@@]12CCN(C)C1=CC(=O)CC2
Systematic name  (4):
  • 1-メチル-6-オキソ-3aα-(3,4-ジメトキシフェニル)-2,3,3a,4,5,6-ヘキサヒドロ-1H-インドール
  • (3aR)-3a-(3,4-ジメトキシフェニル)-1,2,3,3a,4,5-ヘキサヒドロ-1-メチル-6H-インドール-6-オン
  • (3aR)-3a-(3,4-ジメトキシフェニル)-1-メチル-2,3,3a,4,5,6-ヘキサヒドロ-1H-インドール-6-オン
  • (3aR)-3a-(3,4-dimethoxyphenyl)-1-methyl-2,3,3a,4,5,6-hexahydro-1H-indol-6-one
Other name (4):
  • 1-Methyl-6-oxo-3aα-(3,4-dimethoxyphenyl)-2,3,3a,4,5,6-hexahydro-1H-indole
  • (3aR)-3a-(3,4-Dimethoxyphenyl)-1,2,3,3a,4,5-hexahydro-1-methyl-6H-indole-6-one
  • Δ7-メセンブレノン
  • Δ7-Mesembrenone
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