Arbekacin
(2S)-4-amino-N-[(1R,2S,3S,4R,5S)-5-amino-4-[(2R,3R,6S)-3-amino-6-(aminomethyl)oxan-2-yl]oxy-2-[(2S,3R,4S,5S,6R)-4-amino-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-hydroxycyclohexyl]-2-hydroxybutanamide
| Molecular Formula | C22H44N6O10 |
|---|---|
| Molecular Weight | 552.6 g/mol |
| LogP | -6.8 |
| Topological Polar Surface Area | 297.0 A2 |
| Hydrogen Bond Donors | 11 |
| Hydrogen Bond Acceptors | 15 |
| Rotatable Bonds | 10 |
| Exact Mass | 552.3119 |
| Heavy Atoms | 38 |
| Complexity | 757.0 |
Chemical Identifiers
| CAS Number | 51025-85-5 |
|---|---|
| SMILES | C1CC(C(OC1CN)OC2C(CC(C(C2O)OC3C(C(C(C(O3)CO)O)N)O)NC(=O)C(CCN)O)N)N |
| InChIKey | MKKYBZZTJQGVCD-XTCKQBCOSA-N |
📖 Product Overview
Arbekacin (CAS: 51025-85-5) is a chemical compound with molecular formula C22H44N6O10 and molecular weight 552.6 g/mol. Its IUPAC systematic name is (2S)-4-amino-N-[(1R,2S,3S,4R,5S)-5-amino-4-[(2R,3R,6S)-3-amino-6-(aminomethyl)oxan-2-yl]oxy-2-[(2S,3R,4S,5S,6R)-4-amino-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-hydroxycyclohexyl]-2-hydroxybutanamide.
MKKYBZZTJQGVCD-XTCKQBCOSA-N.
SMILES: C1CC(C(OC1CN)OC2C(CC(C(C2O)OC3C(C(C(C(O3)CO)O)N)O)NC(=O)C(CCN)O)N)N.
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