Chem
J-GLOBAL ID：200907019842073831   Nikkaji number：J10.888J

Dezocine

デゾシン
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： C16H23NO
Molecular formula furigana： C16-H23-N-O
Molecular weight： 245.366
InChI： InChI=1S/C16H23NO/c1-16-8-4-2-3-5-12(15(16)17)9-11-6-7-13(18)10-14(11)16/h6-7,10,12,15,18H,2-5,8-9,17H2,1H3/t12-,15-,16+/m0/s1
InChI key： VTMVHDZWSFQSQP-VBNZEHGJSA-N
SMILES： C[C@@]12CCCCC[C@@H](Cc3ccc(O)cc13)[C@@H]2N
Systematic name  (3)：
  • (13S)-13-アミノ-5,6,7,8,9,10,11,12-オクタヒドロ-5-メチル-5α,11α-メタノベンゾシクロデセン-3-オール
  • (1R,9S,15S)-15-アミノ-1-メチルトリシクロ[7.5.1.02,7]ペンタデカ-2,4,6-トリエン-4-オール
  • (1R,9S,15S)-15-amino-1-methyltricyclo[7.5.1.02,7]pentadeca-2,4,6-trien-4-ol
Other name (4)：
  • デゾシン
  • Dezocine
  • WY-16225
  • (13S)-13-Amino-5,6,7,8,9,10,11,12-octahydro-5-methyl-5α,11α-methanobenzocyclodecen-3-ol
CAS registry number： 53648-55-8
KEGG DRUG： D00838
KEGG COMPOUND： C08010
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