Chem
J-GLOBAL ID:200907018658733970   Nikkaji number:J1.029.294H

11-(1-Oxo-12,21-dimethyl-5,12,21,28-tetraazaoctacosane-1-yl)-5,11-dihydro-6H-pyrido[2,3-b][1,4]benzodiazepine-6-one

11-(1-オキソ-12,21-ジメチル-5,12,21,28-テトラアザオクタコサン-1-イル)-5,11-ジヒドロ-6H-ピリド[2,3-b][1,4]ベンゾジアゼピン-6-オン
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: C38H63N7O2
Molecular formula furigana: C38-H63-N7-O2
Molecular weight: 649.969
InChI: InChI=1S/C38H63N7O2/c1-43(31-17-9-5-13-25-39)29-15-7-3-4-8-16-30-44(2)32-18-10-6-14-26-40-27-20-24-36(46)45-35-23-12-11-21-33(35)38(47)42-34-22-19-28-41-37(34)45/h11-12,19,21-23,28,40H,3-10,13-18,20,24-27,29-32,39H2,1-2H3,(H,42,47)
InChI key: SZPRVUSSTLSOHX-UHFFFAOYSA-N
SMILES: CN(CCCCCCN)CCCCCCCCN(C)CCCCCCNCCCC(=O)n1c2ccccc2c(=O)[nH]c2cccnc12
Systematic name  (3):
  • 11-(1-オキソ-12,21-ジメチル-5,12,21,28-テトラアザオクタコサン-1-イル)-5,11-ジヒドロ-6H-ピリド[2,3-b][1,4]ベンゾジアゼピン-6-オン
  • 2-(4-{[6-({8-[(6-アミノヘキシル)(メチル)アミノ]オクチル}(メチル)アミノ)ヘキシル]アミノ}ブタノイル)-2,4,9-トリアザトリシクロ[9.4.0.03,8]ペンタデカ-1(15),3,5,7,11,13-ヘキサエン-10-オン
  • 2-(4-{[6-({8-[(6-aminohexyl)(methyl)amino]octyl}(methyl)amino)hexyl]amino}butanoyl)-2,4,9-triazatricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaen-10-one
Other name (1):
  • 11-(1-Oxo-12,21-dimethyl-5,12,21,28-tetraazaoctacosane-1-yl)-5,11-dihydro-6H-pyrido[2,3-b][1,4]benzodiazepine-6-one
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