Chem
J-GLOBAL ID：200907000576423381   Nikkaji number：J1.950.509J

3,4-(1-Aza-1,3-butadiene-1,4-diyl)pregna-3,5-diene-20-one

3,4-(1-アザ-1,3-ブタジエン-1,4-ジイル)プレグナ-3,5-ジエン-20-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： C24H31NO
Molecular formula furigana： C24-H31-N-O
Molecular weight： 349.518
InChI： InChI=1S/C24H31NO/c1-15(26)18-8-9-19-16-6-7-20-17-5-4-14-25-22(17)11-13-24(20,3)21(16)10-12-23(18,19)2/h4-5,7,14,16,18-19,21H,6,8-13H2,1-3H3/t16-,18+,19-,21-,23+,24-/m0/s1
InChI key： LOPZYPMXEOTXJM-PSWNQGIHSA-N
SMILES： CC(=O)[C@H]1CC[C@H]2[C@@H]3CC=C4c5cccnc5CC[C@]4(C)[C@H]3CC[C@]12C
Systematic name  (3)：
  • 3,4-(1-アザ-1,3-ブタジエン-1,4-ジイル)プレグナ-3,5-ジエン-20-オン
  • 1-[(1R,2S,5S,6S,9S,10S)-1,5-ジメチル-18-アザペンタシクロ[11.8.0.02,10.05,9.014,19]ヘンイコサ-12,14,16,18-テトラエン-6-イル]エタン-1-オン
  • 1-[(1R,2S,5S,6S,9S,10S)-1,5-dimethyl-18-azapentacyclo[11.8.0.02,10.05,9.014,19]henicosa-12,14,16,18-tetraen-6-yl]ethan-1-one
Other name (1)：
  • 3,4-(1-Aza-1,3-butadiene-1,4-diyl)pregna-3,5-diene-20-one
Thsaurus map：
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