Tmc 016
(11E,13Z)-6-[4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-16-ethyl-4-hydroxy-15-[(5-hydroxy-3,4-dimethoxy-6-methyloxan-2-yl)oxymethyl]-5,7,9,13-tetramethyl-1-oxacyclohexadeca-11,13-diene-2,10-dione
Also Known As: Tmc 016|Tmc-016|19-Deformyl-4'-deoxydesmycosin|(11E,13Z)-6-[4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-16-ethyl-4-hydroxy-15-[(5-hydroxy-3,4-dimethoxy-6-methyloxan-2-yl)oxymethyl]-5,7,9,13-tetramethyl-1-oxacyclohexadeca-11,13-diene-2,10-dione|Tylosin, 4A-de((2,6-dideoxy-3-C-methyl-alpha-L-ribo-hexapyranosyl)oxy)-6-de(2-oxoethyl)-6-methyl-
| Molecular Formula | C38H65NO12 |
|---|---|
| Molecular Weight | 727.4507 g/mol |
| LogP | 3.0225 |
| Topological Polar Surface Area | 162.68 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 9 |
| Exact Mass | 727.4507 |
| Monoisotopic Mass | 727.4507 |
| Heavy Atoms | 51 |
| Complexity | 1163.7129 |
Chemical Identifiers
| CAS Number | 85382-79-2 |
|---|---|
| SMILES | CCC1C(/C=C(\C=C\C(=O)C(CC(C(C(C(CC(=O)O1)O)C)OC2C(C(CC(O2)C)N(C)C)O)C)C)/C)COC3C(C(C(C(O3)C)O)OC)OC |
Product Overview
Tmc 016 (CAS 85382-79-2), with molecular formula C38H65NO12 and molecular weight 727.4507 g/mol. IUPAC: (11E,13Z)-6-[4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-16-ethyl-4-hydroxy-15-[(5-hydroxy-3,4-dimethoxy-6-methyloxan-2-yl)oxymethyl]-5,7,9,13-tetramethyl-1-oxacyclohexadeca-11,13-diene-2,10-dione.
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