7-(2-(2-Aminothiazole-4-yl)-2-(1-carboxy-1-methyl)ethoxyiminoacetamido)-3-(3-hydroxy-4-pyridon-1-yl)methyl-3-cephem-4-carboxylic acid
[CAS# 128236-34-0]

Identification

• Name: 7-(2-(2-Aminothiazole-4-yl)-2-(1-carboxy-1-methyl)ethoxyiminoacetamido)-3-(3-hydroxy-4-pyridon-1-yl)methyl-3-cephem-4-carboxylic acid
• Synonyms: (6R,7R)-7-[[(2E)-2-(2-Aminothiazol-4-Yl)-2-(2-Hydroxy-1,1-Dimethyl-2-Oxo-Ethoxy)Imino-Acetyl]Amino]-3-[(3-Hydroxy-4-Oxo-1-Pyridyl)Methyl]-8-Oxo-5-Thia-1-Azabicyclo[4.2.0]Oct-2-Ene-2-Carboxylic Acid; (6R,7R)-7-[[(2E)-2-(2-Amino-4-Thiazolyl)-2-(2-Hydroxy-1,1-Dimethyl-2-Oxoethoxy)Imino-1-Oxoethyl]Amino]-3-[(3-Hydroxy-4-Oxo-1-Pyridyl)Methyl]-8-Oxo-5-Thia-1-Azabicyclo[4.2.0]Oct-2-Ene-2-Carboxylic Acid; (6R,7R)-7-[[(2E)-2-(2-Aminothiazol-4-Yl)-2-(2-Hydroxy-2-Keto-1,1-Dimethyl-Ethoxy)Imino-Acetyl]Amino]-3-[(3-Hydroxy-4-Keto-1-Pyridyl)Methyl]-8-Keto-5-Thia-1-Azabicyclo[4.2.0]Oct-2-Ene-2-Carboxylic Acid
• Molecular Formula: C₂₂H₂₂N₆O₉S₂
• Molecular Weight: 578.57
• CAS Registry Number: 128236-34-0
• SMILES: [C@H]12SCC(=C(N1C(=O)[C@H]2NC(=O)C(=N/OC(C(=O)O)(C)C)/C3=CSC(=N3)N)C(=O)O)CN4C=C(O)C(=O)C=C4
• InChI: 1S/C22H22N6O9S2/c1-22(2,20(35)36)37-26-13(10-8-39-21(23)24-10)16(31)25-14-17(32)28-15(19(33)34)9(7-38-18(14)28)5-27-4-3-11(29)12(30)6-27/h3-4,6,8,14,18,30H,5,7H2,1-2H3,(H2,23,24)(H,25,31)(H,33,34)(H,35,36)/b26-13+/t14-,18-/m1/s1
• InChIKey: OTRYAHNZFLNNCB-KZBLUZIOSA-N

Properties

• Density: 1.797g/cm³ (Cal.)