(2S-(2alpha,5alpha,6beta(R*)))-6-((5-(Acetylamino)-5-Carboxy-1-Oxopentyl)Amino)-3,3-Dimethyl-7-Oxo-4-Thia-1-Azabicyclo(3.2.0)Heptane-2-Carboxylic Acid Disodium Salt
[CAS# 84713-89-3]

Identification

• Name: (2S-(2alpha,5alpha,6beta(R*)))-6-((5-(Acetylamino)-5-Carboxy-1-Oxopentyl)Amino)-3,3-Dimethyl-7-Oxo-4-Thia-1-Azabicyclo(3.2.0)Heptane-2-Carboxylic Acid Disodium Salt
• Synonyms: Disodium (2S,5R,6R)-6-[(5-Acetamido-6-Oxido-6-Oxo-Hexanoyl)Amino]-3,3-Dimethyl-7-Oxo-4-Thia-1-Azabicyclo[3.2.0]Heptane-2-Carboxylate; Disodium (2S,5R,6R)-6-[(5-Acetamido-6-Oxido-1,6-Dioxohexyl)Amino]-3,3-Dimethyl-7-Oxo-4-Thia-1-Azabicyclo[3.2.0]Heptane-2-Carboxylate; Disodium (2S,5R,6R)-6-[(5-Acetamido-6-Keto-6-Oxido-Hexanoyl)Amino]-7-Keto-3,3-Dimethyl-4-Thia-1-Azabicyclo[3.2.0]Heptane-2-Carboxylate
• Molecular Formula: C₁₆H₂₁N₃Na₂O₇S
• Molecular Weight: 445.40
• CAS Registry Number: 84713-89-3
• SMILES: [C@H]12SC([C@@H](N1C(=O)[C@H]2NC(=O)CCCC(NC(=O)C)C([O-])=O)C([O-])=O)(C)C.[Na+].[Na+]
• InChI: 1S/C16H23N3O7S.2Na/c1-7(20)17-8(14(23)24)5-4-6-9(21)18-10-12(22)19-11(15(25)26)16(2,3)27-13(10)19;;/h8,10-11,13H,4-6H2,1-3H3,(H,17,20)(H,18,21)(H,23,24)(H,25,26);;/q;2*+1/p-2/t8?,10-,11+,13-;;/m1../s1
• InChIKey: GOLGDHZBVHFUPX-YKTPBDCMSA-L

Properties

• Boiling point: 847.1°C at 760 mmHg (Cal.)
• Flash point: 466.1°C (Cal.)