Penta-N-Boc Tobramycin O-Tetracetate

Analyte Name

Penta-N-Boc Tobramycin O-Tetracetate

Molecular Formula

C₅₁H₈₅N₅O₂₃

Molecular Weight

1136.24

Accurate Mass

1135.56

SMILES

OC[C@H]1O[C@H](O[C@H]2[C@H](NC(OC(C)(C)C)=O)C[C@H](NC(OC(C)(C)C)=O)[C@@H](O[C@@H]3[C@H](NC(OC(C)(C)C)=O)C[C@H](OC(C)=O)[C@@H](CNC(OC(C)(C)C)=O)O3)[C@@H]2OC(C)=O)[C@H](OC(C)=O)[C@@H](NC(OC(C)(C)C)=O)[C@@H]1OC(C)=O

InChI

InChI=1S/C51H85N5O23/c1-24(58)67-31-21-30(55-45(65)78-50(14,15)16)40(71-32(31)22-52-42(62)75-47(5,6)7)73-35-28(53-43(63)76-48(8,9)10)20-29(54-44(64)77-49(11,12)13)36(39(35)70-27(4)61)74-41-38(69-26(3)60)34(56-46(66)79-51(17,18)19)37(68-25(2)59)33(23-57)72-41/h28-41,57H,20-23H2,1-19H3,(H,52,62)(H,53,63)(H,54,64)(H,55,65)(H,56,66)/t28?,29?,30?,31?,32-,33-,34?,35-,36+,37?,38?,39?,40-,41-/m1/s1

IUPAC

(2S,3R,4S,5S,6R)-2-(((1S,2S,3R,4S,6R)-2-acetoxy-3-(((2R,3R,5S,6R)-5-acetoxy-3-((tert-butoxycarbonyl)amino)-6-(((tert-butoxycarbonyl)amino)methyl)tetrahydro-2H-pyran-2-yl)oxy)-4,6-bis((tert-butoxycarbonyl)amino)cyclohexyl)oxy)-4-((tert-butoxycarbonyl)amino)-6-(hydroxymethyl)tetrahydro-2H-pyran-3,5-diyl diacetate

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat