Chem
J-GLOBAL ID：200907074068933300   Nikkaji number：J1.058.985A

(24S)-24,25-Iminocholesterol

(24S)-24,25-イミノコレステロール
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： C27H45NO
Molecular formula furigana： C27-H45-N-O
Molecular weight： 399.663
InChI： InChI=1S/C27H45NO/c1-17(6-11-24-25(2,3)28-24)21-9-10-22-20-8-7-18-16-19(29)12-14-26(18,4)23(20)13-15-27(21,22)5/h7,17,19-24,28-29H,6,8-16H2,1-5H3/t17-,19+,20+,21-,22+,23+,24+,26+,27-/m1/s1
InChI key： XLTPYRHADZRGAQ-XVYZBDJZSA-N
SMILES： C[C@H](CC[C@@H]1NC1(C)C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
Systematic name  (3)：
  • (24S)-24,25-イミノコレステロール
  • (1R,3aS,3bS,7S,9aR,9bS,11aR)-1-[(2R)-4-[(2S)-3,3-ジメチルアジリジン-2-イル]ブタン-2-イル]-9a,11a-ジメチル-1H,2H,3H,3aH,3bH,4H,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-シクロペンタ[a]フェナントレン-7-オール
  • (1R,3aS,3bS,7S,9aR,9bS,11aR)-1-[(2R)-4-[(2S)-3,3-dimethylaziridin-2-yl]butan-2-yl]-9a,11a-dimethyl-1H,2H,3H,3aH,3bH,4H,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-7-ol
Other name (1)：
  • (24S)-24,25-Iminocholesterol
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