Benzathine cefotaxime
[CAS# 127627-69-4]

Identification

• Name: Benzathine cefotaxime
• Synonyms: (6S,7S)-3-(Acetoxymethyl)-7-[[(2Z)-2-(2-Aminothiazol-4-Yl)-2-Methoxyimino-Acetyl]Amino]-8-Oxo-5-Thia-1-Azabicyclo[4.2.0]Oct-2-Ene-2-Carboxylic Acid; (6S,7S)-3-(Acetoxymethyl)-7-[[(2Z)-2-(2-Aminothiazol-4-Yl)-2-Methoxyimino-Acetyl]Amino]-8-Oxo-5-Thia-1-Azabicyclo[4.2.0]Oct-2-Ene-2-Carboxylic Acid; N,N'-Dibenzylethane-1,2-Diamine; (6S,7S)-3-(Acetoxymethyl)-7-[[(2Z)-2-(2-Amino-4-Thiazolyl)-2-Methoxyimino-1-Oxoethyl]Amino]-8-Oxo-5-Thia-1-Azabicyclo[4.2.0]Oct-2-Ene-2-Carboxylic Acid; (6S,7S)-3-(Acetoxymethyl)-7-[[(2Z)-2-(2-Amino-4-Thiazolyl)-2-Methoxyimino-1-Oxoethyl]Amino]-8-Oxo-5-Thia-1-Azabicyclo[4.2.0]Oct-2-Ene-2-Carboxylic Acid; N,N'-Dibenzylethane-1,2-Diamine
• Molecular Formula: C₄₈H₅₄N₁₂O₁₄S₄
• Molecular Weight: 1151.27
• CAS Registry Number: 127627-69-4
• SMILES: [C@@H]12SCC(=C(N1C(=O)[C@@H]2NC(=O)C(=N/OC)\C3=CSC(=N3)N)C(=O)O)COC(=O)C.[C@@H]45SCC(=C(N4C(=O)[C@@H]5NC(=O)C(=N/OC)\C6=CSC(=N6)N)C(=O)O)COC(=O)C.C(NCCNCC7=CC=CC=C7)C8=CC=CC=C8
• InChI: 1S/2C16H17N5O7S2.C16H20N2/c2*1-6(22)28-3-7-4-29-14-10(13(24)21(14)11(7)15(25)26)19-12(23)9(20-27-2)8-5-30-16(17)18-8;1-3-7-15(8-4-1)13-17-11-12-18-14-16-9-5-2-6-10-16/h2*5,10,14H,3-4H2,1-2H3,(H2,17,18)(H,19,23)(H,25,26);1-10,17-18H,11-14H2/b2*20-9-;/t2*10-,14-;/m00./s1
• InChIKey: IILSVORLNYJFCF-KDBQXVQCSA-N