Azinothricin
2-[6-(4-ethyl-6-methyl-5-oxoocta-2,6-dien-2-yl)-2-hydroxy-5-methyloxan-2-yl]-2-hydroxy-N-[7-hydroxy-20-(1-hydroxyethyl)-6-(methoxymethyl)-3,4-dimethyl-2,5,8,15,19,22-hexaoxo-17-propan-2-yl-18-oxa-1,4,7,13,14,21,27-heptazatricyclo[21.4.0.09,14]heptacosan-16-yl]butanamide
Also Known As: Azinothricin
| Molecular Formula | C49H80N8O15 |
|---|---|
| Molecular Weight | 1020.57434 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 306.0 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 17 |
| Rotatable Bonds | 13 |
| Exact Mass | 1020.57434 |
| Monoisotopic Mass | 1020.57434 |
| Heavy Atoms | 72 |
| Complexity | 2070.0 |
Chemical Identifiers
| CAS Number | 101342-90-9 |
|---|---|
| SMILES | CCC(C=C(C)C1C(CCC(O1)(C(CC)(C(=O)NC2C(OC(=O)C(NC(=O)C3CCCNN3C(=O)C(N(C(=O)C(N(C(=O)C4CCCNN4C2=O)O)COC)C)C)C(C)O)C(C)C)O)O)C)C(=O)C(=CC)C |
| InChIKey | SWYLPIMCJADFNO-UHFFFAOYSA-N |
Product Overview
Azinothricin (CAS 101342-90-9), with molecular formula C49H80N8O15 and molecular weight 1020.57434 g/mol. IUPAC: 2-[6-(4-ethyl-6-methyl-5-oxoocta-2,6-dien-2-yl)-2-hydroxy-5-methyloxan-2-yl]-2-hydroxy-N-[7-hydroxy-20-(1-hydroxyethyl)-6-(methoxymethyl)-3,4-dimethyl-2,5,8,15,19,22-hexaoxo-17-propan-2-yl-18-oxa-1,4,7,13,14,21,27-heptazatricyclo[21.4.0.09,14]heptacosan-16-yl]butanamide.
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