Chem
J-GLOBAL ID：200907014778957230   Nikkaji number：J543.574I

CGP-54626A

(シクロヘキシルメチル)[(S)-3-[[(S)-1-(3,4-ジクロロフェニル)エチル]アミノ]-2-ヒドロキシプロピル]ホスフィン酸
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： C18H28Cl2NO3P
Molecular formula furigana： C18-H28-CL2-N-O3-P
Molecular weight： 408.300
InChI： InChI=1S/C18H28Cl2NO3P/c1-13(15-7-8-17(19)18(20)9-15)21-10-16(22)12-25(23,24)11-14-5-3-2-4-6-14/h7-9,13-14,16,21-22H,2-6,10-12H2,1H3,(H,23,24)/t13-,16-/m0/s1
InChI key： JGGVBBYJRQOPPA-BBRMVZONSA-N
SMILES： C[C@H](NC[C@H](O)CP(=O)(O)CC1CCCCC1)c1ccc(Cl)c(Cl)c1
Systematic name  (3)：
  • (シクロヘキシルメチル)[(S)-3-[[(S)-1-(3,4-ジクロロフェニル)エチル]アミノ]-2-ヒドロキシプロピル]ホスフィン酸
  • (シクロヘキシルメチル)[(2S)-3-{[(1S)-1-(3,4-ジクロロフェニル)エチル]アミノ}-2-ヒドロキシプロピル]ホスフィン酸
  • (cyclohexylmethyl)[(2S)-3-{[(1S)-1-(3,4-dichlorophenyl)ethyl]amino}-2-hydroxypropyl]phosphinic acid
Other name (2)：
  • (Cyclohexylmethyl)[(S)-3-[[(S)-1-(3,4-dichlorophenyl)ethyl]amino]-2-hydroxypropyl]phosphinic acid
  • CGP-54626A
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