Chem
J-GLOBAL ID：200907087480646795   Nikkaji number：J836.413C

Cholestamine

コレスタミン
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： C27H49N
Molecular formula furigana： C27-H49-N
Molecular weight： 387.696
InChI： InChI=1S/C27H49N/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h18-25H,6-17,28H2,1-5H3/t19-,20-,21+,22-,23+,24-,25-,26-,27+/m0/s1
InChI key： RJNGJYWAIUJHOJ-WPAFHKMSSA-N
SMILES： CC(C)CCC[C@H](C)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[C@H](N)CC[C@]4(C)[C@H]3CC[C@]12C
Systematic name  (3)：
  • (20S)-5α-コレスタン-3α-アミン
  • (1R,3aS,3bR,5aS,7R,9aS,9bS,11aR)-9a,11a-ジメチル-1-[(2S)-6-メチルヘプタン-2-イル]-ヘキサデカヒドロ-1H-シクロペンタ[a]フェナントレン-7-アミン
  • (1R,3aS,3bR,5aS,7R,9aS,9bS,11aR)-9a,11a-dimethyl-1-[(2S)-6-methylheptan-2-yl]-hexadecahydro-1H-cyclopenta[a]phenanthren-7-amine
Other name (3)：
  • コレスタミン
  • Cholestamine
  • (20S)-5α-Cholestan-3α-amine
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