Monotrifluoroacetyl gentamicin

N-[2-[4,6-diamino-3-[3,5-dihydroxy-5-methyl-4-(methylamino)oxan-2-yl]oxy-2-hydroxycyclohexyl]oxy-6-[1-(methylamino)ethyl]oxan-3-yl]-2,2,2-trifluoroacetamide

Also Known As: Mtfa-gentamicin|Monotrifluoroacetyl gentamicin|Methacryloylthiobenzene|N-[2-[4,6-diamino-3-[3,5-dihydroxy-5-methyl-4-(methylamino)oxan-2-yl]oxy-2-hydroxycyclohexyl]oxy-6-[1-(methylamino)ethyl]oxan-3-yl]-2,2,2-trifluoroacetamide|4,6-diamino-3-{[3-deoxy-4-c-methyl-3-(methylamino)pentopyranosyl]oxy}-2-hydroxycyclohexyl 2,3,4,6,7-pentadeoxy-6-(methylamino)-2-[(trifluoroacetyl)amino]heptopyranoside|4,6-Diamino-3-{[3-deoxy-4-C-methyl-3-(methylamino)pentopyranosyl]oxy}-2-hydroxycyclohexyl 2,3,4,6,7-pentadeoxy-6-(methylamino)-2-[(2,2,2-trifluoro-1-hydroxyethylidene)amino]heptopyranoside|D-Streptamine, O-3-deoxy-4-C-methyl-3-(methylamino)-beta-L-arabinopyranosyl-(1-6)-O-(2,3,4,6,7-pentadeoxy-6-(methylamino)-2-((trifluoroacetyl)amino)-alpha-D-ribo-heptopyranosyl-(1-4))-2-deoxy-

Molecular Formula	C23H42F3N5O8
Molecular Weight	573.2985 g/mol
LogP	-2.7
Topological Polar Surface Area	203.0 Ų
Hydrogen Bond Donors	8
Hydrogen Bond Acceptors	15
Rotatable Bonds	8
Exact Mass	573.2985
Monoisotopic Mass	573.2985
Heavy Atoms	39
Complexity	831.0

Chemical Identifiers

CAS Number	6326-52-9
SMILES	CC(C1CCC(C(O1)OC2C(CC(C(C2O)OC3C(C(C(CO3)(C)O)NC)O)N)N)NC(=O)C(F)(F)F)NC
InChIKey	HTCMBMWOHKKJOC-UHFFFAOYSA-N