HIT ID: HIT212658843
Cas No: 28002-18-8
分子式: C16H20N2Na2O7S2
分子量: 462.44
常用名: Sulbenicillin disodium
氢键受体数 (HBA): 7
氢键供体数 (HBD): 3
LogP: 0.38029066
IUPAC: (2S,5R,6R)-3,3-dimethyl-7-oxo-6-(2-phenyl-2-sulfoacetamido)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid disodium hydride
IUPAC: (2S,5R,6R)-3,3-dimethyl-7-oxo-6-(2-phenyl-2-sulfoacetamido)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid disodium hydride
SMILES: [NaH].[NaH].CC1(C)S[C@@H]2[C@H](NC(=O)C(c3ccccc3)S(O)(=O)=O)C(=O)N2[C@H]1C(O)=O
SMILES: [NaH].[NaH].CC1(C)S[C@@H]2[C@H](NC(=O)C(c3ccccc3)S(O)(=O)=O)C(=O)N2[C@H]1C(O)=O
InChI key: RYZCBKUGDWLVSB-ABKNTCSPSA-N
