Analyte Name

N4(streptamino),N2',6'(gluco)-tris(tertBuyloxycarbonyl)-N6(streptamino)-Aminocarbonyl-N3''(gluco)-trifluoroacetyl Tobramycin

CAS Number

502610-98-2

Molecular Formula

C36 H61 F3 N6 O17

Molecular Weight

906.895

Accurate Mass

906.405

SMILES

CC(C)(C)OC(=O)NC[C@H]1O[C@H](O[C@H]2[C@H](O)[C@@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@H](NC(=O)C(F)(F)F)[C@H]3O)[C@@H](C[C@@H]2NC(=O)OC(C)(C)C)NC(=O)N)[C@@H](C[C@@H]1O)NC(=O)OC(C)(C)C

InChI

InChI=1S/C36H61F3N6O17/c1-33(2,3)60-30(53)41-12-18-17(47)11-16(44-32(55)62-35(7,8)9)26(56-18)58-25-15(43-31(54)61-34(4,5)6)10-14(42-29(40)52)24(23(25)50)59-27-22(49)20(21(48)19(13-46)57-27)45-28(51)36(37,38)39/h14-27,46-50H,10-13H2,1-9H3,(H,41,53)(H,43,54)(H,44,55)(H,45,51)(H3,40,42,52)/t14-,15+,16-,17+,18-,19-,20+,21-,22-,23-,24+,25-,26-,27-/m1/s1

IUPAC

tert-butyl N-[(1S,2R,3S,4S,5R)-5-(carbamoylamino)-4-[(2S,3R,4S,5S,6R)-3,5-dihydroxy-6-(hydroxymethyl)-4-[(2,2,2-trifluoroacetyl)amino]oxan-2-yl]oxy-3-hydroxy-2-[(2R,3R,5S,6R)-5-hydroxy-3-[(2-methylpropan-2-yl)oxycarbonylamino]-6-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]oxan-2-yl]oxycyclohexyl]carbamate

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat