Oleandocetin
[(3R,5S,6S,7R,8S,9R,12R,13S,14R,15R)-6-[(2S,3R,4S,6R)-3-acetyloxy-4-(dimethylamino)-6-methyloxan-2-yl]oxy-8-[(2R,4S,5S,6S)-5-acetyloxy-4-methoxy-6-methyloxan-2-yl]oxy-5,7,9,12,13,15-hexamethyl-10,16-dioxo-1,11-dioxaspiro[2.13]hexadecan-14-yl] acetate
Also Known As: TROLEANDOMYCIN, Oleandocetin, Cyclamycin, Troleandomicina, Troleandomycine, Oleandocetine, Tribiocillina, Evramicina, Matromicina, Treolmicina, Triocetin, Viamicina, Triolan, Wytrion, Aovine
| Molecular Formula | C41H67NO15 |
|---|---|
| Molecular Weight | 813.45105 g/mol |
| LogP | 3.62 |
| Topological Polar Surface Area | 184.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 9 |
| Exact Mass | 813.45105 |
| Heavy Atoms | 57 |
| Complexity | 1419 |
Chemical Identifiers
| CAS Number | 2751-09-9 |
|---|---|
| SMILES | C[C@@H]1C[C@@H]([C@H]([C@@H](O1)O[C@H]2[C@H](C[C@@]3(CO3)C(=O)[C@@H]([C@@H]([C@H]([C@H](OC(=O)[C@@H]([C@H]([C@@H]2C)O[C@H]4C[C@@H]([C@H]([C@@H](O4)C)OC(=O)C)OC)C)C)C)OC(=O)C)C)C)OC(=O)C)N(C)C |
Product Overview
Oleandocetin (CAS 2751-09-9), with molecular formula C41H67NO15 and molecular weight 813.45105 g/mol. IUPAC: [(3R,5S,6S,7R,8S,9R,12R,13S,14R,15R)-6-[(2S,3R,4S,6R)-3-acetyloxy-4-(dimethylamino)-6-methyloxan-2-yl]oxy-8-[(2R,4S,5S,6S)-5-acetyloxy-4-methoxy-6-methyloxan-2-yl]oxy-5,7,9,12,13,15-hexamethyl-10,16-dioxo-1,11-dioxaspiro[2.13]hexadecan-14-yl] acetate.
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