TL;DR: Miharamycin hydrochloride (CAS 11055-37-1) is a chemical compound with molecular formula C20H32Cl2N10O9 and molecular weight 626.1731 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[(3S,3aS,4R,5R,7R,7aR)-7-(2-aminopurin-9-yl)-3,3a,4-trihydroxy-2,3,4,5,7,7a-hexahydrofuro[2,3-c]pyran-5-yl]-2-[[(2S)-2-amino-5-[carbamimidoyl(hydroxy)amino]pentanoyl]amino]acetic acid;dihydrochloride
Also Known As: MIHARAMYCIN HYDROCHLORIDE, [(3S,3aS,4R,5R,7R,7aR)-7-(2-Amino-9H-purin-9-yl)-3,3a,4-trihydroxyhexahydro-2H-furo[2,3-c]pyran-5-yl][(N~5~-carbamimidoyl-N~5~-hydroxy-L-ornithyl)amino]acetic acid--hydrogen chloride (1/2), 2-[(3S,3aS,4R,5R,7R,7aR)-7-(2-aminopurin-9-yl)-3,3a,4-trihydroxy-2,3,4,5,7,7a-hexahydrofuro[2,3-c]pyran-5-yl]-2-[[(2S)-2-amino-5-[carbamimidoyl(hydroxy)amino]pentanoyl]amino]acetic acid dihydrochloride
| Molecular Formula | C20H32Cl2N10O9 |
| Molecular Weight | 626.1731 g/mol |
| XLogP | -3.73723 |
| Topological Polar Surface Area (TPSA) | 315.0 Ų |
| Hydrogen Bond Donors | 12 |
| Hydrogen Bond Acceptors | 15 |
| Rotatable Bonds | 10 |
| Exact Mass | 626.1731 Da |
| Heavy Atoms | 41 |
| Complexity | 934.0 |
| SMILES | C1[C@@H]([C@@]2([C@@H]([C@H](O[C@H]([C@@H]2O1)N3C=NC4=CN=C(N=C43)N)C(C(=O)O)NC(=O)[C@H](CCCN(C(=N)N)O)N)O)O)O.Cl.Cl |
| InChIKey | XAPVZONAQQBAEZ-QOZSLKEPSA-N |
The XLogP value of -3.73723 indicates that Miharamycin hydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 315.0 Ų indicates high polarity, suggesting Miharamycin hydrochloride may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Miharamycin hydrochloride has 12 hydrogen bond donor(s) and 15 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Miharamycin hydrochloride is 11055-37-1.
The molecular formula of Miharamycin hydrochloride is C20H32Cl2N10O9.
The molecular weight of Miharamycin hydrochloride is 626.1731 g/mol.
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