Chem
J-GLOBAL ID:200907075837925916   Nikkaji number:J78.104E

(+)-Butaclamol

(+)-ブタクラモール
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: C25H31NO
Molecular formula furigana: C25-H31-N-O
Molecular weight: 361.529
InChI: InChI=1S/C25H31NO/c1-24(2,3)25(27)13-14-26-16-21-19-9-5-4-7-17(19)11-12-18-8-6-10-20(23(18)21)22(26)15-25/h4-10,21-22,27H,11-16H2,1-3H3/t21-,22-,25-/m0/s1
InChI key: ZZJYIKPMDIWRSN-HWBMXIPRSA-N
SMILES: CC(C)(C)[C@]1(O)CCN2C[C@H]3c4ccccc4CCc4cccc([C@@H]2C1)c34
Systematic name  (3):
  • [3S,(+)]-3-tert-ブチル-2,3,4,4aα,8,9,13bβ,14-オクタヒドロ-1H-ベンゾ[6,7]シクロヘプタ[1,2,3-de]ピリド[2,1-a]イソキノリン-3α-オール
  • (1S,6S,8S)-6-tert-ブチル-3-アザペンタシクロ[11.8.1.03,8.09,22.016,21]ドコサ-9(22),10,12,16,18,20-ヘキサエン-6-オール
  • (1S,6S,8S)-6-tert-butyl-3-azapentacyclo[11.8.1.03,8.09,22.016,21]docosa-9(22),10,12,16,18,20-hexaen-6-ol
Other name (8):
  • (+)-ブタクラモール
  • (+)-Butaclamol
  • [3S,(+)]-3-tert-Butyl-2,3,4,4aα,8,9,13bβ,14-octahydro-1H-benzo[6,7]cyclohepta[1,2,3-de]pyrido[2,1-a]isoquinolin-3α-ol
  • d-ブタクラモール
  • d-Butaclamol
Show all
CAS registry number: 56245-67-1
Application (4):
dopaminergic drug ,  psychotropic drug ,  dopamine antagonist ,  antipsychotic agent
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