Chem
J-GLOBAL ID：200907090605758877   Nikkaji number：J1.219.907D

2α-Iodo-17-octylandrosta-4-ene-3-one

2α-ヨード-17-オクチルアンドロスタ-4-エン-3-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： C27H43IO
Molecular formula furigana： C27-H43-I-O
Molecular weight： 510.544
InChI： InChI=1S/C27H43IO/c1-4-5-6-7-8-9-10-19-12-14-22-21-13-11-20-17-25(29)24(28)18-27(20,3)23(21)15-16-26(19,22)2/h17,19,21-24H,4-16,18H2,1-3H3/t19?,21-,22-,23-,24+,26+,27-/m0/s1
InChI key： CCBGVYJNEGGDQV-RGRDQEFNSA-N
SMILES： CCCCCCCCC1CC[C@H]2[C@@H]3CCC4=CC(=O)[C@H](I)C[C@]4(C)[C@H]3CC[C@]12C
Systematic name  (3)：
  • 2α-ヨード-17-オクチルアンドロスタ-4-エン-3-オン
  • (3aS,3bS,8R,9aR,9bS,11aR)-8-ヨード-9a,11a-ジメチル-1-オクチル-1H,2H,3H,3aH,3bH,4H,5H,7H,8H,9H,9aH,9bH,10H,11H,11aH-シクロペンタ[a]フェナントレン-7-オン
  • (3aS,3bS,8R,9aR,9bS,11aR)-8-iodo-9a,11a-dimethyl-1-octyl-1H,2H,3H,3aH,3bH,4H,5H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-7-one
Other name (1)：
  • 2α-Iodo-17-octylandrosta-4-ene-3-one
Thsaurus map：
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