3'-Deoxykanamycin C
[CAS# 65566-75-8]

Identification

• Name: 3'-Deoxykanamycin C
• Synonyms: (2S,3R,4S,5S,6R)-4-Amino-2-[(1S,2S,3R,4S,6R)-4,6-Diamino-3-[(2S,3R,5S,6R)-3-Amino-5-Hydroxy-6-(Hydroxymethyl)Tetrahydropyran-2-Yl]Oxy-2-Hydroxy-Cyclohexoxy]-6-(Hydroxymethyl)Tetrahydropyran-3,5-Diol; (2S,3R,4S,5S,6R)-4-Amino-2-[(1S,2S,3R,4S,6R)-4,6-Diamino-3-[[(2S,3R,5S,6R)-3-Amino-5-Hydroxy-6-(Hydroxymethyl)-2-Tetrahydropyranyl]Oxy]-2-Hydroxycyclohexoxy]-6-(Hydroxymethyl)Tetrahydropyran-3,5-Diol; (2S,3R,4S,5S,6R)-4-Amino-2-[(1S,2S,3R,4S,6R)-4,6-Diamino-3-[(2S,3R,5S,6R)-3-Amino-5-Hydroxy-6-Methylol-Tetrahydropyran-2-Yl]Oxy-2-Hydroxy-Cyclohexoxy]-6-Methylol-Tetrahydropyran-3,5-Diol
• Molecular Formula: C₁₈H₃₆N₄O₁₀
• Molecular Weight: 468.50
• CAS Registry Number: 65566-75-8
• SMILES: [C@@H]1(O[C@@H]([C@H]([C@@H]([C@H]1O)N)O)CO)O[C@H]2[C@@H](C[C@@H]([C@H]([C@@H]2O)O[C@H]3O[C@@H]([C@H](C[C@H]3N)O)CO)N)N
• InChI: 1S/C18H36N4O10/c19-5-1-6(20)16(32-18-13(27)11(22)12(26)10(4-24)30-18)14(28)15(5)31-17-7(21)2-8(25)9(3-23)29-17/h5-18,23-28H,1-4,19-22H2/t5-,6+,7+,8-,9+,10+,11-,12+,13+,14-,15+,16-,17+,18+/m0/s1
• InChIKey: IDSYVBBNVYBBAF-PBSUHMDJSA-N

Properties

• Density: 1.563g/cm³ (Cal.)
• Boiling point: 789.381°C at 760 mmHg (Cal.)
• Flash point: 431.202°C (Cal.)

References

• (1): Park et al.. Discovery of parallel pathways of kanamycin biosynthesis allows antibiotic manipulation, Nature Chemical Biology, 2011