6-(1-Hydroxyethyl)-2-(1-Acetimidoylpyrrolidin-3-Ylthio)-1-Methyl-1-Carbapen-2-En-3-Carboxylic Acid
[CAS# 103730-44-5]

Identification

• Name: 6-(1-Hydroxyethyl)-2-(1-Acetimidoylpyrrolidin-3-Ylthio)-1-Methyl-1-Carbapen-2-En-3-Carboxylic Acid
• Synonyms: (4S,5S,6R)-6-(1-Hydroxyethyl)-3-[[1-(1-Iminoethyl)-3-Pyrrolidinyl]Thio]-4-Methyl-7-Oxo-1-Azabicyclo[3.2.0]Hept-2-Ene-2-Carboxylic Acid; (4S,5S,6R)-3-[(1-Acetimidoylpyrrolidin-3-Yl)Thio]-6-(1-Hydroxyethyl)-7-Keto-4-Methyl-1-Azabicyclo[3.2.0]Hept-2-Ene-2-Carboxylic Acid; 1-Haptmcc
• Molecular Formula: C₁₆H₂₃N₃O₄S
• Molecular Weight: 353.44
• CAS Registry Number: 103730-44-5
• SMILES: [C@H]13N(C(=O)[C@H]1[C@H](O)C)C(=C(SC2CN(CC2)C(=N)C)[C@H]3C)C(=O)O
• InChI: 1S/C16H23N3O4S/c1-7-12-11(8(2)20)15(21)19(12)13(16(22)23)14(7)24-10-4-5-18(6-10)9(3)17/h7-8,10-12,17,20H,4-6H2,1-3H3,(H,22,23)/t7-,8+,10?,11-,12+/m0/s1
• InChIKey: NZOABRUICAKEBQ-ZXDKXGFCSA-N