Chem
J-GLOBAL ID：200907003544748571   Nikkaji number：J316.570A

3β-(Acetylamino)-5α-cholest-1-ene

3β-(アセチルアミノ)-5α-コレスタ-1-エン
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： C29H49NO
Molecular formula furigana： C29-H49-N-O
Molecular weight： 427.717
InChI： InChI=1S/C29H49NO/c1-19(2)8-7-9-20(3)25-12-13-26-24-11-10-22-18-23(30-21(4)31)14-16-28(22,5)27(24)15-17-29(25,26)6/h14,16,19-20,22-27H,7-13,15,17-18H2,1-6H3,(H,30,31)/t20-,22+,23+,24+,25-,26+,27+,28+,29-/m1/s1
InChI key： BZADJKCGNIQOLB-SPTWOZHASA-N
SMILES： CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[C@@H](NC(=O)C)C=C[C@]4(C)[C@H]3CC[C@]12C
Systematic name  (3)：
  • 3β-(アセチルアミノ)-5α-コレスタ-1-エン
  • N-[(1R,3aS,3bS,5aS,7R,9aR,9bS,11aR)-9a,11a-ジメチル-1-[(2R)-6-メチルヘプタン-2-イル]-1H,2H,3H,3aH,3bH,4H,5H,5aH,6H,7H,9aH,9bH,10H,11H,11aH-シクロペンタ[a]フェナントレン-7-イル]アセトアミド
  • N-[(1R,3aS,3bS,5aS,7R,9aR,9bS,11aR)-9a,11a-dimethyl-1-[(2R)-6-methylheptan-2-yl]-1H,2H,3H,3aH,3bH,4H,5H,5aH,6H,7H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-7-yl]acetamide
Other name (1)：
  • 3β-(Acetylamino)-5α-cholest-1-ene
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