Chem
J-GLOBAL ID：200907018163046659   Nikkaji number：J1.073.017A

KNI-547

2,3-ジメチル-4-オキソ-4-[[(1S,2S)-1-ベンジル-2-ヒドロキシ-3-オキソ-3-[(4R)-4α-(tert-ブチルカルバモイル)-2-チアゾリジニル]プロピル]アミノ]ブタン酸
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： C24H35N3O6S
Molecular formula furigana： C24-H35-N3-O6-S
Molecular weight： 493.620
InChI： InChI=1S/C24H35N3O6S/c1-13(14(2)23(32)33)20(30)25-16(11-15-9-7-6-8-10-15)18(28)19(29)22-26-17(12-34-22)21(31)27-24(3,4)5/h6-10,13-14,16-18,22,26,28H,11-12H2,1-5H3,(H,25,30)(H,27,31)(H,32,33)/t13?,14?,16-,17-,18-,22?/m0/s1
InChI key： LSNUZOQDIIOZQQ-JITHDLHDSA-N
SMILES： CC(C(C)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)C(=O)C1N[C@@H](CS1)C(=O)NC(C)(C)C)C(=O)O
Systematic name  (3)：
  • 2,3-ジメチル-4-オキソ-4-[[(1S,2S)-1-ベンジル-2-ヒドロキシ-3-オキソ-3-[(4R)-4α-(tert-ブチルカルバモイル)-2-チアゾリジニル]プロピル]アミノ]ブタン酸
  • 3-{[(2S,3S)-4-[(4R)-4-(tert-ブチルカルバモイル)-1,3-チアゾリジン-2-イル]-3-ヒドロキシ-4-オキソ-1-フェニルブタン-2-イル]カルバモイル}-2,3-ジメチルプロパン酸
  • 3-{[(2S,3S)-4-[(4R)-4-(tert-butylcarbamoyl)-1,3-thiazolidin-2-yl]-3-hydroxy-4-oxo-1-phenylbutan-2-yl]carbamoyl}-2,3-dimethylpropanoic acid
Other name (2)：
  • 2,3-Dimethyl-4-oxo-4-[[(1S,2S)-1-benzyl-2-hydroxy-3-oxo-3-[(4R)-4α-(tert-butylcarbamoyl)-2-thiazolidinyl]propyl]amino]butanoic acid
  • KNI-547
Thsaurus map：
Thesaurus Map

Return to Previous Page

TOP

BOTTOM