Chem
J-GLOBAL ID：200907010970085900   Nikkaji number：J1.128.193A

6α-Aminopenicillanic acid tert-butyl ester

6α-アミノペニシラン酸tert-ブチル
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： C12H20N2O3S
Molecular formula furigana： C12-H20-N2-O3-S
Molecular weight： 272.360
InChI： InChI=1S/C12H20N2O3S/c1-11(2,3)17-10(16)7-12(4,5)18-9-6(13)8(15)14(7)9/h6-7,9H,13H2,1-5H3/t6-,7+,9-/m1/s1
InChI key： OBRRPGLKBNFYNU-BKPPORCPSA-N
SMILES： CC(C)(C)OC(=O)[C@@H]1N2[C@H](SC1(C)C)[C@H](N)C2=O
Systematic name  (4)：
  • 6α-アミノペニシラン酸tert-ブチル
  • (2S,5β)-3,3-ジメチル-6α-アミノ-7-オキソ-4-チア-1-アザビシクロ[3.2.0]ヘプタン-2β-カルボン酸tert-ブチル
  • tert-ブチル (2S,5R,6R)-6-アミノ-3,3-ジメチル-7-オキソ-4-チア-1-アザビシクロ[3.2.0]ヘプタン-2-カルボキシラート
  • tert-butyl (2S,5R,6R)-6-amino-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate
Other name (2)：
  • 6α-Aminopenicillanic acid tert-butyl ester
  • (2S,5β)-3,3-Dimethyl-6α-amino-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2β-carboxylic acid tert-butyl ester
Thsaurus map：
Thesaurus Map

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