Chem
J-GLOBAL ID：200907000601460556   Nikkaji number：J264.973J

(6R)-4β-Methyl-8-oxo-7α-phenylacetylamino-5-thia-1-azatricyclo[4.2.0.02,4]octane-2β-carboxylic acid methyl ester

(6R)-4β-メチル-8-オキソ-7α-フェニルアセチルアミノ-5-チア-1-アザトリシクロ[4.2.0.02,4]オクタン-2β-カルボン酸メチル
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： C17H18N2O4S
Molecular formula furigana： C17-H18-N2-O4-S
Molecular weight： 346.400
InChI： InChI=1S/C17H18N2O4S/c1-16-9-17(16,15(22)23-2)19-13(21)12(14(19)24-16)18-11(20)8-10-6-4-3-5-7-10/h3-7,12,14H,8-9H2,1-2H3,(H,18,20)/t12-,14-,16+,17+/m1/s1
InChI key： MIYKQCILPNILMB-IRWJRLHMSA-N
SMILES： COC(=O)[C@@]12C[C@]1(C)S[C@@H]1[C@H](NC(=O)Cc3ccccc3)C(=O)N21
Systematic name  (3)：
  • (6R)-4β-メチル-8-オキソ-7α-フェニルアセチルアミノ-5-チア-1-アザトリシクロ[4.2.0.02,4]オクタン-2β-カルボン酸メチル
  • メチル (2S,4S,6R,7R)-4-メチル-8-オキソ-7-(2-フェニルアセトアミド)-5-チア-1-アザトリシクロ[4.2.0.02,4]オクタン-2-カルボキシラート
  • methyl (2S,4S,6R,7R)-4-methyl-8-oxo-7-(2-phenylacetamido)-5-thia-1-azatricyclo[4.2.0.02,4]octane-2-carboxylate
Other name (1)：
  • (6R)-4β-Methyl-8-oxo-7α-phenylacetylamino-5-thia-1-azatricyclo[4.2.0.02,4]octane-2β-carboxylic acid methyl ester
Thsaurus map：
Thesaurus Map

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