[2S-[2alpha,5alpha,6beta(S*)]]-3,3-Dimethyl-6-[[[[[3-(Methylsulfonyl)-2-Oxo-1-Imidazolidinyl]Carbonyl]Amino]Phenylacetyl]Amino]-7-Oxo-4-Thia-1-Azabicyclo[3.2.0]Heptane-2-Carboxylic Acid Monosodium Salt
[CAS# 42057-22-7]

Identification

• Classification: API >> Antibiotics >> Penicillin
• Name: [2S-[2alpha,5alpha,6beta(S*)]]-3,3-Dimethyl-6-[[[[[3-(Methylsulfonyl)-2-Oxo-1-Imidazolidinyl]Carbonyl]Amino]Phenylacetyl]Amino]-7-Oxo-4-Thia-1-Azabicyclo[3.2.0]Heptane-2-Carboxylic Acid Monosodium Salt
• Synonyms: (2S,5R,6R)-3,3-Dimethyl-6-[[(2R)-2-[(3-Methylsulfonyl-2-Oxo-Imidazolidine-1-Carbonyl)Amino]-2-Phenyl-Acetyl]Amino]-7-Oxo-4-Thia-1-Azabicyclo[3.2.0]Heptane-2-Carboxylic Acid; Sodium; (2S,5R,6R)-3,3-Dimethyl-6-[[(2R)-2-[[(3-Methylsulfonyl-2-Oxo-1-Imidazolidinyl)-Oxomethyl]Amino]-1-Oxo-2-Phenylethyl]Amino]-7-Oxo-4-Thia-1-Azabicyclo[3.2.0]Heptane-2-Carboxylic Acid; Sodium; (2S,5R,6R)-7-Keto-6-[[(2R)-2-[(2-Keto-3-Mesyl-Imidazolidine-1-Carbonyl)Amino]-2-Phenyl-Acetyl]Amino]-3,3-Dimethyl-4-Thia-1-Azabicyclo[3.2.0]Heptane-2-Carboxylic Acid; Sodium
• Molecular Formula: C₂₁H₂₅N₅NaO₈S₂
• Molecular Weight: 562.57
• CAS Registry Number: 42057-22-7
• EINECS: 255-640-5
• SMILES: [Na].[C@H]12SC([C@@H](N1C(=O)[C@H]2NC(=O)[C@H](NC(=O)N3C(=O)N([S](=O)(=O)C)CC3)C4=CC=CC=C4)C(=O)O)(C)C
• InChI: 1S/C21H25N5O8S2.Na/c1-21(2)14(18(29)30)26-16(28)13(17(26)35-21)22-15(27)12(11-7-5-4-6-8-11)23-19(31)24-9-10-25(20(24)32)36(3,33)34;/h4-8,12-14,17H,9-10H2,1-3H3,(H,22,27)(H,23,31)(H,29,30);/t12-,13-,14+,17-;/m1./s1
• InChIKey: SGVORSZSYKDVFT-ZBJAFUORSA-N