Chem
J-GLOBAL ID：200907011022711964   Nikkaji number：J2.723.022I

3α-(tert-Butyldimethylsiloxy)-17-(1-chloro-7-isoquinolinyl)-5α-androstane-17-ol

3α-(tert-ブチルジメチルシロキシ)-17-(1-クロロ-7-イソキノリニル)-5α-アンドロスタン-17-オール
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： C34H50ClNO2Si
Molecular formula furigana： C34-H50-CL-N-O2-SI
Molecular weight： 568.310
InChI： InChI=1S/C34H50ClNO2Si/c1-31(2,3)39(6,7)38-25-12-16-32(4)23(20-25)10-11-26-28(32)13-17-33(5)29(26)14-18-34(33,37)24-9-8-22-15-19-36-30(35)27(22)21-24/h8-9,15,19,21,23,25-26,28-29,37H,10-14,16-18,20H2,1-7H3/t23-,25+,26+,28-,29-,32-,33-,34?/m0/s1
InChI key： XWBIRTBYOUVVAK-HWODMUMNSA-N
SMILES： CC(C)(C)[Si](C)(C)O[C@@H]1CC[C@@]2(C)[C@@H](CC[C@H]3[C@@H]4CCC(O)(c5ccc6ccnc(Cl)c6c5)[C@@]4(C)CC[C@H]23)C1
Systematic name  (4)：
  • 3α-(tert-ブチルジメチルシリルオキシ)-17-(1-クロロ-7-イソキノリル)-5α-アンドロスタン-17-オール
  • 3α-(tert-ブチルジメチルシロキシ)-17-(1-クロロ-7-イソキノリニル)-5α-アンドロスタン-17-オール
  • (3aS,3bR,5aS,7R,9aS,9bS,11aS)-7-[(tert-ブチルジメチルシリル)オキシ]-1-(1-クロロイソキノリン-7-イル)-9a,11a-ジメチル-ヘキサデカヒドロ-1H-シクロペンタ[a]フェナントレン-1-オール
  • (3aS,3bR,5aS,7R,9aS,9bS,11aS)-7-[(tert-butyldimethylsilyl)oxy]-1-(1-chloroisoquinolin-7-yl)-9a,11a-dimethyl-hexadecahydro-1H-cyclopenta[a]phenanthren-1-ol
Other name (2)：
  • 3α-(tert-Butyldimethylsilyloxy)-17-(1-chloro-7-isoquinolyl)-5α-androstane-17-ol
  • 3α-(tert-Butyldimethylsiloxy)-17-(1-chloro-7-isoquinolinyl)-5α-androstane-17-ol
Thsaurus map：
Thesaurus Map

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