Chem
J-GLOBAL ID：200907060153630740
Nikkaji number：J1.694.931K
(1R)-1β-(2-Mesylethyl)-1-ethyl-1,2,3,4,6,7,12,12bα-octahydroindolo[2,3-a]quinolizine-4-one
(1R)-1β-(2-メシルエチル)-1-エチル-1,2,3,4,6,7,12,12bα-オクタヒドロインドロ[2,3-a]キノリジン-4-オン
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
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
Molecular formula： C20H26N2O3S
Molecular formula furigana： C20-H26-N2-O3-S
Molecular weight： 374.500
InChI：
InChI=1S/C20H26N2O3S/c1-3-20(11-13-26(2,24)25)10-8-17(23)22-12-9-15-14-6-4-5-7-16(14)21-18(15)19(20)22/h4-7,19,21H,3,8-13H2,1-2H3/t19-,20+/m0/s1
InChI key：
HGUKDWDWPVVESU-VQTJNVASSA-N
SMILES：
CC[C@]1(CCS(=O)(=O)C)CCC(=O)N2CCc3c([nH]c4ccccc34)[C@@H]12
Systematic name (3)：
- (1R)-1β-(2-メシルエチル)-1-エチル-1,2,3,4,6,7,12,12bα-オクタヒドロインドロ[2,3-a]キノリジン-4-オン
- (1R,12bR)-1-エチル-1-(2-メタンスルホニルエチル)-1H,2H,3H,4H,6H,7H,12H,12bH-インドロ[2,3-a]キノリジン-4-オン
- (1R,12bR)-1-ethyl-1-(2-methanesulfonylethyl)-1H,2H,3H,4H,6H,7H,12H,12bH-indolo[2,3-a]quinolizin-4-one
- (1R)-1β-(2-Mesylethyl)-1-ethyl-1,2,3,4,6,7,12,12bα-octahydroindolo[2,3-a]quinolizine-4-one
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