Monotrifluoroacetyl Gentamicin
[CAS# 54667-98-0]

Identification

• Name: Monotrifluoroacetyl Gentamicin
• Synonyms: N-[2-[4,6-Diamino-3-(3,5-Dihydroxy-5-Methyl-4-Methylamino-Tetrahydropyran-2-Yl)Oxy-2-Hydroxy-Cyclohexoxy]-6-(1-Methylaminoethyl)Tetrahydropyran-3-Yl]-2,2,2-Trifluoro-Acetamide; N-[2-[4,6-Diamino-3-[(3,5-Dihydroxy-5-Methyl-4-Methylamino-2-Tetrahydropyranyl)Oxy]-2-Hydroxycyclohexoxy]-6-(1-Methylaminoethyl)-3-Tetrahydropyranyl]-2,2,2-Trifluoroacetamide; N-[2-[4,6-Diamino-3-(3,5-Dihydroxy-5-Methyl-4-Methylamino-Oxan-2-Yl)Oxy-2-Hydroxy-Cyclohexyl]Oxy-6-(1-Methylaminoethyl)Oxan-3-Yl]-2,2,2-Trifluoro-Ethanamide
• Molecular Formula: C₂₃H₄₂F₃N₅O₈
• Molecular Weight: 573.61
• CAS Registry Number: 54667-98-0
• SMILES: CNC1C(COC(C1O)OC3C(C(OC2C(CCC(O2)C(NC)C)NC(C(F)(F)F)=O)C(CC3N)N)O)(O)C
• InChI: 1S/C23H42F3N5O8/c1-9(29-3)13-6-5-12(31-21(34)23(24,25)26)19(37-13)38-16-10(27)7-11(28)17(14(16)32)39-20-15(33)18(30-4)22(2,35)8-36-20/h9-20,29-30,32-33,35H,5-8,27-28H2,1-4H3,(H,31,34)
• InChIKey: HTCMBMWOHKKJOC-UHFFFAOYSA-N

Properties

• Density: 1.383g/cm³ (Cal.)
• Boiling point: 720.516°C at 760 mmHg (Cal.)
• Flash point: 389.554°C (Cal.)