Chem
J-GLOBAL ID：200907060897982636   Nikkaji number：J2.163.562F

Mearsine

メアルシン
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： C9H13NO
Molecular formula furigana： C9-H13-N-O
Molecular weight： 151.209
InChI： InChI=1S/C9H13NO/c1-5-3-7-4-8(11)9(5)6(2)10-7/h5,7,9H,3-4H2,1-2H3/t5-,7-,9-/m0/s1
InChI key： XWZBTIGBVQYTRB-GCHGDONOSA-N
SMILES： C[C@H]1C[C@H]2CC(=O)[C@@H]1C(=N2)C
Systematic name  (3)：
  • (1β,4β)-3,5β-ジメチル-2-アザビシクロ[2.2.2]オクタ-2-エン-8-オン
  • (1S,4S,8S)-3,8-ジメチル-2-アザビシクロ[2.2.2]オクタ-2-エン-5-オン
  • (1S,4S,8S)-3,8-dimethyl-2-azabicyclo[2.2.2]oct-2-en-5-one
Other name (5)：
  • (1β,4β)-3,5β-Dimethyl-2-azabicyclo[2.2.2]octa-2-ene-8-one
  • Mearsine
  • メアルシン
  • (-)-メアルシン
  • (-)-Mearsine
KEGG COMPOUND： C10158
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