Glutaryl-7-Aminocephalosporanic Acid
[CAS# 27920-90-7]

Identification

• Name: Glutaryl-7-Aminocephalosporanic Acid
• Synonyms: (6R,7R)-3-(Acetoxymethyl)-7-[(5-Hydroxy-5-Oxo-Pentanoyl)Amino]-8-Oxo-5-Thia-1-Azabicyclo[4.2.0]Oct-2-Ene-2-Carboxylic Acid; (6R,7R)-3-(Acetoxymethyl)-7-[(5-Hydroxy-1,5-Dioxopentyl)Amino]-8-Oxo-5-Thia-1-Azabicyclo[4.2.0]Oct-2-Ene-2-Carboxylic Acid; (6R,7R)-3-(Acetoxymethyl)-7-[(5-Hydroxy-5-Keto-Pentanoyl)Amino]-8-Keto-5-Thia-1-Azabicyclo[4.2.0]Oct-2-Ene-2-Carboxylic Acid
• Molecular Formula: C₁₅H₁₈N₂O₈S
• Molecular Weight: 386.38
• CAS Registry Number: 27920-90-7
• SMILES: [C@H]12SCC(=C(N1C(=O)[C@H]2NC(=O)CCCC(=O)O)C(=O)O)COC(=O)C
• InChI: 1S/C15H18N2O8S/c1-7(18)25-5-8-6-26-14-11(13(22)17(14)12(8)15(23)24)16-9(19)3-2-4-10(20)21/h11,14H,2-6H2,1H3,(H,16,19)(H,20,21)(H,23,24)/t11-,14-/m1/s1
• InChIKey: IXUSDMGLUJZNFO-BXUZGUMPSA-N

Properties

• Density: 1.569g/cm³ (Cal.)
• Boiling point: 803.26°C at 760 mmHg (Cal.)
• Flash point: 439.596°C (Cal.)