Chem
J-GLOBAL ID：200907086998469610   Nikkaji number：J555.524H

Epibatidine

エピバチジン
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： C11H13ClN2
Molecular formula furigana： C11-H13-CL-N2
Molecular weight： 208.690
InChI： InChI=1S/C11H13ClN2/c12-11-4-1-7(6-13-11)9-5-8-2-3-10(9)14-8/h1,4,6,8-10,14H,2-3,5H2/t8-,9+,10+/m0/s1
InChI key： NLPRAJRHRHZCQQ-IVZWLZJFSA-N
SMILES： Clc1ccc(cn1)[C@H]1C[C@@H]2CC[C@H]1N2
Systematic name  (9)：
  • 2-クロロ-5-[(1β,4β)-7-アザビシクロ[2.2.1]ヘプタン-2β-イル]ピリジン
  • (1β,4β)-2β-(6-クロロ-3-ピリジニル)-7-アザビシクロ[2.2.1]ヘプタン
  • (1R,4S)-2β-(6-クロロ-3-ピリジル)-7-アザビシクロ[2.2.1]ヘプタン
  • (1R,4S)-2β-(2-クロロ-5-ピリジル)-7-アザビシクロ[2.2.1]ヘプタン
  • (1R,4S)-2β-(6-クロロ-3-ピリジニル)-7-アザビシクロ[2.2.1]ヘプタン
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Other name (10)：
  • (1R,4S)-2β-(6-Chloro-3-pyridinyl)-7-azabicyclo[2.2.1]heptane
  • (+)-エピバチジン
  • (+)-Epibatidine
  • (1R,2R,4S)-2-(6-Chloro-3-pyridyl)-7-azabicyclo[2.2.1]heptane
  • (R)-エピバチジン
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CAS registry number： 140111-52-0
KEGG COMPOUND： C11690
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