N-Acetyl-Glutamylsulfamethoxazole
[CAS# 72756-69-5]

Identification

• Name: N-Acetyl-Glutamylsulfamethoxazole
• Synonyms: (2S)-2-[Acetyl-[4-[(5-Methylisoxazol-3-Yl)Sulfamoyl]Phenyl]Amino]-5-Amino-5-Oxo-Pentanoic Acid; (2S)-2-[Acetyl-[4-[(5-Methyl-3-Isoxazolyl)Sulfamoyl]Phenyl]Amino]-5-Amino-5-Oxopentanoic Acid; (2S)-2-[Acetyl-[4-[(5-Methylisoxazol-3-Yl)Sulfamoyl]Phenyl]Amino]-5-Amino-5-Keto-Valeric Acid
• Molecular Formula: C₁₇H₂₀N₄O₇S
• Molecular Weight: 424.43
• CAS Registry Number: 72756-69-5
• SMILES: [C@H](C(=O)O)(N(C1=CC=C(C=C1)[S](=O)(=O)NC2=NOC(=C2)C)C(=O)C)CCC(=O)N
• InChI: 1S/C17H20N4O7S/c1-10-9-16(19-28-10)20-29(26,27)13-5-3-12(4-6-13)21(11(2)22)14(17(24)25)7-8-15(18)23/h3-6,9,14H,7-8H2,1-2H3,(H2,18,23)(H,19,20)(H,24,25)/t14-/m0/s1
• InChIKey: DMSYWUMJYPNFOY-AWEZNQCLSA-N

Properties

• Density: 1.493g/cm³ (Cal.)
• Boiling point: 764.777°C at 760 mmHg (Cal.)
• Flash point: 416.323°C (Cal.)