Chem
J-GLOBAL ID:200907051719518617   Nikkaji number:J2.093.556A

N-Phenyl-1α,3β-bis(tert-butyldimethylsiloxy)-5,8α-epiazo-17β-[4-ethyl-4-(triethylsiloxy)hexyloxymethyl]-5α-androsta-6-ene-20,21-dicarbimide

N-フェニル-1α,3β-ビス(tert-ブチルジメチルシロキシ)-5,8α-エピアゾ-17β-[4-エチル-4-(トリエチルシロキシ)ヘキシルオキシメチル]-5α-アンドロスタ-6-エン-20,21-ジカルボイミド
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: C54H93N3O6Si3
Molecular formula furigana: C54-H93-N3-O6-SI3
Molecular weight: 964.608
InChI: InChI=1S/C54H93N3O6Si3/c1-18-52(19-2,63-66(20-3,21-4)22-5)32-26-36-60-39-40-29-30-43-50(40,12)33-31-44-51(13)45(62-65(16,17)49(9,10)11)37-42(61-64(14,15)48(6,7)8)38-53(51)34-35-54(43,44)57-47(59)55(46(58)56(53)57)41-27-24-23-25-28-41/h23-25,27-28,34-35,40,42-45H,18-22,26,29-33,36-39H2,1-17H3/t40-,42+,43-,44-,45+,50-,51+,53-,54+/m1/s1
InChI key: LSFXRMGEEHXGRY-PQKZNBJFSA-N
SMILES: CCC(CC)(CCCOC[C@H]1CC[C@@H]2[C@]1(C)CC[C@@H]1[C@@]3(C)[C@H](C[C@@H](C[C@@]43C=C[C@]21n1n4c(=O)n(c2ccccc2)c1=O)O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)O[Si](CC)(CC)CC
Systematic name  (3):
  • N-フェニル-1α,3β-ビス(tert-ブチルジメチルシロキシ)-5,8α-エピアゾ-17β-[4-エチル-4-(トリエチルシロキシ)ヘキシルオキシメチル]-5α-アンドロスタ-6-エン-20,21-ジカルボイミド
  • (1S,2R,5S,6S,9R,10R,11S,13R,15S)-11,13-ビス[(tert-ブチルジメチルシリル)オキシ]-5-[({4-エチル-4-[(トリエチルシリル)オキシ]ヘキシル}オキシ)メチル]-6,10-ジメチル-18-フェニル-16,18,20-トリアザヘキサシクロ[13.5.2.01,9.02,6.010,15.016,20]ドコサ-21-エン-17,19-ジオン
  • (1S,2R,5S,6S,9R,10R,11S,13R,15S)-11,13-bis[(tert-butyldimethylsilyl)oxy]-5-[({4-ethyl-4-[(triethylsilyl)oxy]hexyl}oxy)methyl]-6,10-dimethyl-18-phenyl-16,18,20-triazahexacyclo[13.5.2.01,9.02,6.010,15.016,20]docos-21-ene-17,19-dione
Other name (1):
  • N-Phenyl-1α,3β-bis(tert-butyldimethylsiloxy)-5,8α-epiazo-17β-[4-ethyl-4-(triethylsiloxy)hexyloxymethyl]-5α-androsta-6-ene-20,21-dicarbimide
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