Chem
J-GLOBAL ID：200907068353802570   Nikkaji number：J359.332K

Trapoxin A

トラポキシンA
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： C34H42N4O6
Molecular formula furigana： C34-H42-N4-O6
Molecular weight： 602.732
InChI： InChI=1S/C34H42N4O6/c39-29(30-22-44-30)18-9-3-8-16-25-31(40)36-26(20-23-12-4-1-5-13-23)32(41)37-27(21-24-14-6-2-7-15-24)34(43)38-19-11-10-17-28(38)33(42)35-25/h1-2,4-7,12-15,25-28,30H,3,8-11,16-22H2,(H,35,42)(H,36,40)(H,37,41)/t25-,26-,27-,28+,30-/m0/s1
InChI key： GXVXXETYXSPSOA-UFEOFEBPSA-N
SMILES： O=C(CCCCC[C@@H]1NC(=O)[C@H]2CCCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccccc2)NC1=O)[C@@H]1CO1
Systematic name  (4)：
  • (4aR,7S,10S,13S)-10,13-ジベンジル-7-[6-オキソ-6-[(S)-オキシラニル]ヘキシル]-1,2,3,4,9,10-ヘキサヒドロ-4aH-6,9,12,14a-テトラアザベンゾシクロドデセン-5,8,11,14(6H,7H,12H,13H)-テトラオン
  • シクロ[L-Phe-L-Phe-D-Hpr-6-[2-[(S)-オキシラニル]-2-オキソエチル]-L-Nle-]
  • (3S,6S,9S,15aR)-6,9-ジベンジル-3-{6-[(2S)-オキシラン-2-イル]-6-オキソヘキシル}-テトラデカヒドロ-1H-ピリド[1,2-a]1,4,7,10-テトラアザシクロドデカン-1,4,7,10-テトラオン
  • (3S,6S,9S,15aR)-6,9-dibenzyl-3-{6-[(2S)-oxiran-2-yl]-6-oxohexyl}-tetradecahydro-1H-pyrido[1,2-a]1,4,7,10-tetraazacyclododecane-1,4,7,10-tetrone
Other name (5)：
  • Trapoxin A
  • トラポキシンA
  • (4aR,7S,10S,13S)-10,13-Dibenzyl-7-[6-oxo-6-[(S)-oxiranyl]hexyl]-1,2,3,4,9,10-hexahydro-4aH-6,9,12,14a-tetraazabenzocyclododecene-5,8,11,14(6H,7H,12H,13H)-tetrone
  • Cyclo[L-Phe-L-Phe-D-Hpr-6-[2-[(S)-oxiranyl]-2-oxoethyl]-L-Nle-]
  • RF-1023A
CAS registry number： 133155-89-2
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