Chem
J-GLOBAL ID：200907028620371507   Nikkaji number：J930.889J

CP-320473

(3R)-N-[(S)-1,2-ジカルボキシエチル]-1-(2,2-ジメチルプロピル)-5α-(1-ナフタレニル)-7-クロロ-2-オキソ-1,2,3,5-テトラヒドロ-4,1-ベンゾオキサゼピン-3β-アセトアミド
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： C30H31ClN2O7
Molecular formula furigana： C30-H31-CL-N2-O7
Molecular weight： 567.040
InChI： InChI=1S/C30H31ClN2O7/c1-30(2,3)16-33-23-12-11-18(31)13-21(23)27(20-10-6-8-17-7-4-5-9-19(17)20)40-24(28(33)37)15-25(34)32-22(29(38)39)14-26(35)36/h4-13,22,24,27H,14-16H2,1-3H3,(H,32,34)(H,35,36)(H,38,39)/t22-,24+,27+/m0/s1
InChI key： GXDQAFKUUPODFF-CAKYRVLISA-N
SMILES： CC(C)(C)CN1c2ccc(Cl)cc2[C@H](O[C@H](CC(=O)N[C@@H](CC(=O)O)C(=O)O)C1=O)c1cccc2ccccc12
Systematic name  (3)：
  • (3R)-N-[(S)-1,2-ジカルボキシエチル]-1-(2,2-ジメチルプロピル)-5α-(1-ナフタレニル)-7-クロロ-2-オキソ-1,2,3,5-テトラヒドロ-4,1-ベンゾオキサゼピン-3β-アセトアミド
  • (2S)-2-{2-[(3R,5R)-7-クロロ-1-(2,2-ジメチルプロピル)-5-(ナフタレン-1-イル)-2-オキソ-1,2,3,5-テトラヒドロ-4,1-ベンゾオキサゼピン-3-イル]アセトアミド}ブタン二酸
  • (2S)-2-{2-[(3R,5R)-7-chloro-1-(2,2-dimethylpropyl)-5-(naphthalen-1-yl)-2-oxo-1,2,3,5-tetrahydro-4,1-benzoxazepin-3-yl]acetamido}butanedioic acid
Other name (2)：
  • CP-320473
  • (3R)-N-[(S)-1,2-Dicarboxyethyl]-1-(2,2-dimethylpropyl)-5α-(1-naphthalenyl)-7-chloro-2-oxo-1,2,3,5-tetrahydro-4,1-benzoxazepine-3β-acetamide
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