TL;DR: Nitracidomycin B (CAS 103527-98-6) is a chemical compound with molecular formula C12H22N2O6 and molecular weight 290.1478 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[(5-carboxy-4-hydroxy-2-methylheptan-3-yl)amino]-N-methoxy-2-oxoethanimine oxide
Also Known As: Nitracidomycin B, 2-[(5-carboxy-4-hydroxy-2-methylheptan-3-yl)amino]-N-methoxy-2-oxoethanimine oxide
| Molecular Formula | C12H22N2O6 |
| Molecular Weight | 290.1478 g/mol |
| XLogP | 1.2 |
| Topological Polar Surface Area (TPSA) | 125.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 290.1478 Da |
| Heavy Atoms | 20 |
| Complexity | 369.0 |
| SMILES | CCC(C(C(C(C)C)NC(=O)C=[N+]([O-])OC)O)C(=O)O |
| InChIKey | KQZPUTFJOHDSFS-UHFFFAOYSA-N |
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Nitracidomycin B. The TPSA of 125.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Nitracidomycin B. Following Lipinski's Rule of Five, Nitracidomycin B has 3 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Nitracidomycin B is 103527-98-6.
The molecular formula of Nitracidomycin B is C12H22N2O6.
The molecular weight of Nitracidomycin B is 290.1478 g/mol.
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