TL;DR: para-Nitrobenzyl-oxime-tylosine (CAS 145144-30-5) is a chemical compound with molecular formula C53H83N3O19 and molecular weight 1065.5621 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[(10Z,11Z,13E)-6-[5-(4,5-dihydroxy-4,6-dimethyloxan-2-yl)oxy-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-16-ethyl-4-hydroxy-15-[(5-hydroxy-3,4-dimethoxy-6-methyloxan-2-yl)oxymethyl]-5,9,13-trimethyl-10-[(4-nitrophenyl)methoxyimino]-2-oxo-1-oxacyclohexadeca-11,13-dien-7-yl]acetaldehyde
Also Known As: para-Nitrobenzyl-oxime-tylosine, S-5556, S 5556, Tylosin, 9-(O-((4-nitrophenyl)methyl)oxime), 2-[(10Z,11Z,13E)-6-[5-(4,5-dihydroxy-4,6-dimethyloxan-2-yl)oxy-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-16-ethyl-4-hydroxy-15-[(5-hydroxy-3,4-dimethoxy-6-methyloxan-2-yl)oxymethyl]-5,9,13-trimethyl-10-[(4-nitrophenyl)methoxyimino]-2-oxo-1-oxacyclohexadeca-11,13-dien-7-yl]acetaldehyde
| Molecular Formula | C53H83N3O19 |
| Molecular Weight | 1065.5621 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 289.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 21 |
| Rotatable Bonds | 16 |
| Exact Mass | 1065.5621 Da |
| Heavy Atoms | 75 |
| Complexity | 1900.0 |
| SMILES | CCC1C(/C=C(/C=C\C(=N/OCC2=CC=C(C=C2)[N+](=O)[O-])\C(CC(C(C(C(CC(=O)O1)O)C)OC3C(C(C(C(O3)C)OC4CC(C(C(O4)C)O)(C)O)N(C)C)O)CC=O)C)\C)COC5C(C(C(C(O5)C)O)OC)OC |
| InChIKey | FASAVLQPELYIAC-ISHIWQPESA-N |
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for para-Nitrobenzyl-oxime-tylosine. The TPSA of 289.0 Ų indicates high polarity, suggesting para-Nitrobenzyl-oxime-tylosine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, para-Nitrobenzyl-oxime-tylosine has 5 hydrogen bond donor(s) and 21 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of para-Nitrobenzyl-oxime-tylosine is 145144-30-5.
The molecular formula of para-Nitrobenzyl-oxime-tylosine is C53H83N3O19.
The molecular weight of para-Nitrobenzyl-oxime-tylosine is 1065.5621 g/mol.
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