Ephenamine penicilline
HIT214319422
sdf文件结构编辑类似物检索
HIT ID: HIT214319422
Cas No: 7177-43-7
分子式: C31H35N3O5S
分子量: 561.7
常用名: Ephenamine penicilline
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: (1R,2R)-2-(methylamino)-1,2-diphenylethan-1-ol; (2S,5R,6R)-3,3-dimethyl-7-oxo-6-(2-phenylacetamido)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
IUPAC: (1R,2R)-2-(methylamino)-1,2-diphenylethan-1-ol; (2S,5R,6R)-3,3-dimethyl-7-oxo-6-(2-phenylacetamido)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
SMILES: CN[C@@H]([C@H](O)c1ccccc1)c1ccccc1.[H][C@]12SC(C)(C)[C@@H](N1C(=O)[C@H]2NC(=O)Cc1ccccc1)C(O)=O
SMILES: CN[C@@H]([C@H](O)c1ccccc1)c1ccccc1.[H][C@]12SC(C)(C)[C@@H](N1C(=O)[C@H]2NC(=O)Cc1ccccc1)C(O)=O
InChI key: XQBNHSTXTGKXIL-XBZXDWPMSA-N
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