Chem
J-GLOBAL ID：200907017735565591   Nikkaji number：J259.409I

[3H]Sch-39166

(6aS)-11-クロロ-5,6,6aβ,8,9,13bα-ヘキサヒドロ-7-メチル(2,3,4-3H3)-7H-ベンゾ[d]ナフト[2,1-b]アゼピン-12-オール
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： C19H17[3H]3ClNO
Molecular formula furigana： C19-H20-CL-N-O
Molecular weight： 319.850
InChI： InChI=1S/C19H20ClNO/c1-21-9-8-13-10-16(20)18(22)11-15(13)19-14-5-3-2-4-12(14)6-7-17(19)21/h2-5,10-11,17,19,22H,6-9H2,1H3/t17-,19+/m0/s1/i2T,3T,4T
InChI key： DMJWENQHWZZWDF-PLWDMDDASA-N
SMILES： c1([3H])cc2[C@H]3[C@H](CCc2c([3H])c1[3H])N(C)CCc1cc(Cl)c(O)cc31
Systematic name  (3)：
  • (6aS)-11-クロロ-5,6,6aβ,8,9,13bα-ヘキサヒドロ-7-メチル(2,3,4-3H3)-7H-ベンゾ[d]ナフト[2,1-b]アゼピン-12-オール
  • (1S,11S)-5-クロロ-10-メチル(15,16,17-3H3)-10-アザテトラシクロ[9.8.0.02,7.014,19]ノナデカ-2,4,6,14(19),15,17-ヘキサエン-4-オール
  • (1S,11S)-5-chloro-10-methyl(15,16,17-3H3)-10-azatetracyclo[9.8.0.02,7.014,19]nonadeca-2,4,6,14(19),15,17-hexaen-4-ol
Other name (2)：
  • [3H]Sch-39166
  • (6aS)-11-Chloro-5,6,6aβ,8,9,13bα-hexahydro-7-methyl(2,3,4-3H3)-7H-benzo[d]naphtho[2,1-b]azepine-12-ol
Thsaurus map：
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