Gentamicin C2 Pentaacetate Salt (Mixture of C2 and C2a)

Analyte Name

Gentamicin C2 pentaacetate salt (mixture of C2 and C2a)

Molecular Formula

C20 H41 N5 O7 . 5 C2 H4 O2

Molecular Weight

763.83

Accurate Mass

763.4062

SMILES

CN[C@@H]1[C@@H](O)[C@@H](O[C@H]2[C@H](N)C[C@H](N)[C@@H](O[C@H]3O[C@@H](CC[C@H]3N)C(C)N)[C@@H]2O)OC[C@]1(C)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O

InChI

InChI=1S/C20H41N5O7.5C2H4O2/c1-8(21)12-5-4-9(22)18(30-12)31-15-10(23)6-11(24)16(13(15)26)32-19-14(27)17(25-3)20(2,28)7-29-19;5*1-2(3)4/h8-19,25-28H,4-7,21-24H2,1-3H3;5*1H3,(H,3,4)/t8?,9-,10+,11-,12+,13+,14-,15-,16+,17-,18-,19-,20+;;;;;/m1...../s1

IUPAC

acetic acid;(2R,3R,4R,5R)-2-[(1S,2S,3R,4S,6R)-4,6-diamino-3-[(2R,3R,6S)-3-amino-6-(1-aminoethyl)tetrahydropyran-2-yl]oxy-2-hydroxy-cyclohexoxy]-5-methyl-4-(methylamino)tetrahydropyran-3,5-diol

Alternate CAS Number

Free amine of C2: 287916-51-2

Storage Temperature

-20°C

Shipping Temperature

Dry Pack

Country of Origin

CANADA

Product Format

Neat

Purity

>95% (HPLC)