Chem
J-GLOBAL ID:200907082634402159
Nikkaji number:J2.392.865E
(7aα)-1-Methyl-3aβ-(3,4-dimethoxyphenyl)octahydro-1H-indole
(7aα)-1-メチル-3aβ-(3,4-ジメトキシフェニル)オクタヒドロ-1H-インドール
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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:
C17 H25 NO2
Molecular formula furigana:
C17-H25-N-O2
Molecular weight:
275.392
InChI:
InChI=1S/C17H25NO2/c1-18-11-10-17(9-5-4-6-16(17)18)13-7-8-14(19-2)15(12-13)20-3/h7-8,12,16H,4-6,9-11H2,1-3H3/t16-,17+/m1/s1
InChI key:
GBPVTGHCALDTNY-SJORKVTESA-N
SMILES:
COc1ccc(cc1OC)[C@]12CCN(C)[C@@H]1CCCC2
Systematic name (4):
(7aα)-1-メチル-3aβ-(3,4-ジメトキシフェニル)オクタヒドロ-1H-インドール
(3aS,7aα)-1-メチル-3aβ-(3,4-ジメトキシフェニル)オクタヒドロ-1H-インドール
(3aS,7aR)-3a-(3,4-ジメトキシフェニル)-1-メチル-オクタヒドロ-1H-インドール
(3aS,7aR)-3a-(3,4-dimethoxyphenyl)-1-methyl-octahydro-1H-indole
Other name (2):
(7aα)-1-Methyl-3aβ-(3,4-dimethoxyphenyl)octahydro-1H-indole
(3aS,7aα)-1-Methyl-3aβ-(3,4-dimethoxyphenyl)octahydro-1H-indole
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