(6R)-7beta-[[(S)-[(Aminocarbonyl)Amino](2-Thienyl)Acetyl]Amino]-7alpha-Methoxy-3-[(1-Methyl-1H-Tetrazol-5-Yl)Thiomethyl]Cepham-3-Ene-4-Carboxylic Acid
[CAS# 65700-47-2]

Identification

• Name: (6R)-7beta-[[(S)-[(Aminocarbonyl)Amino](2-Thienyl)Acetyl]Amino]-7alpha-Methoxy-3-[(1-Methyl-1H-Tetrazol-5-Yl)Thiomethyl]Cepham-3-Ene-4-Carboxylic Acid
• Synonyms: (6R,7S)-7-Methoxy-3-[(1-Methyltetrazol-5-Yl)Sulfanylmethyl]-8-Oxo-7-[[2-(2-Thienyl)-2-Ureido-Acetyl]Amino]-5-Thia-1-Azabicyclo[4.2.0]Oct-2-Ene-2-Carboxylic Acid; (6R,7S)-7-Methoxy-3-[[(1-Methyl-5-Tetrazolyl)Thio]Methyl]-8-Oxo-7-[[1-Oxo-2-(2-Thienyl)-2-Ureidoethyl]Amino]-5-Thia-1-Azabicyclo[4.2.0]Oct-2-Ene-2-Carboxylic Acid; (6R,7S)-8-Keto-7-Methoxy-3-[[(1-Methyltetrazol-5-Yl)Thio]Methyl]-7-[[2-(2-Thienyl)-2-Ureido-Acetyl]Amino]-5-Thia-1-Azabicyclo[4.2.0]Oct-2-Ene-2-Carboxylic Acid
• Molecular Formula: C₁₈H₂₀N₈O₆S₃
• Molecular Weight: 540.59
• CAS Registry Number: 65700-47-2
• SMILES: [C@H]12SCC(=C(N1C(=O)[C@@]2(OC)NC(=O)C(NC(=O)N)C3=CC=CS3)C(=O)O)CSC4=NN=N[N]4C
• InChI: 1S/C18H20N8O6S3/c1-25-17(22-23-24-25)35-7-8-6-34-15-18(32-2,14(30)26(15)11(8)13(28)29)21-12(27)10(20-16(19)31)9-4-3-5-33-9/h3-5,10,15H,6-7H2,1-2H3,(H,21,27)(H,28,29)(H3,19,20,31)/t10?,15-,18+/m1/s1
• InChIKey: HPNPXNUAIRGSKT-HIYAZECZSA-N

Properties

• Density: 1.865g/cm³ (Cal.)