硫酸异帕米星
TL;DR: 硫酸异帕米星 (CAS 393574-17-9) is a chemical compound with molecular formula C22H45N5O16S and molecular weight 667.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
硫酸异帕米星
(2S)-3-amino-N-[(1R,2S,3S,4R,5S)-5-amino-4-[(2R,3R,4S,5S,6R)-6-(aminomethyl)-3,4,5-trihydroxyoxan-2-yl]oxy-2-[(2R,3R,4R,5R)-3,5-dihydroxy-5-methyl-4-(methylamino)oxan-2-yl]oxy-3-hydroxycyclohexyl]-2-hydroxypropanamide;sulfuric acid
Also Known As: isepamicin sulfate, Isepamicin sulphate, Isepacin, Ispallin, Exacin
| Molecular Formula | C22H45N5O16S |
|---|---|
| Molecular Weight | 667.26 g/mol |
| LogP | -8.1772 |
| Topological Polar Surface Area | 381.0 Ų |
| Hydrogen Bond Donors | 14 |
| Hydrogen Bond Acceptors | 20 |
| Rotatable Bonds | 9 |
| Exact Mass | 667.2582 |
| Heavy Atoms | 44 |
| Complexity | 899.0 |
Chemical Identifiers
| CAS Number | 393574-17-9 |
|---|---|
| SMILES | C[C@@]1(CO[C@@H]([C@@H]([C@H]1NC)O)O[C@H]2[C@@H](C[C@@H]([C@H]([C@@H]2O)O[C@@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CN)O)O)O)N)NC(=O)[C@H](CN)O)O.OS(=O)(=O)O |
| InChIKey | DDXRHRXGIWOVDQ-MGAUJLSLSA-N |
Product Overview
硫酸异帕米星 (CAS 393574-17-9), with molecular formula C22H45N5O16S and molecular weight 667.26 g/mol. IUPAC: (2S)-3-amino-N-[(1R,2S,3S,4R,5S)-5-amino-4-[(2R,3R,4S,5S,6R)-6-(aminomethyl)-3,4,5-trihydroxyoxan-2-yl]oxy-2-[(2R,3R,4R,5R)-3,5-dihydroxy-5-methyl-4-(methylamino)oxan-2-yl]oxy-3-hydroxycyclohexyl]-2-hydroxypropanamide;sulfuric acid.
Chemical Property Profile of 硫酸异帕米星
Property Insights of 硫酸异帕米星
The XLogP value of -8.1772 indicates that 硫酸异帕米星 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 381.0 Ų indicates high polarity, suggesting 硫酸异帕米星 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 硫酸异帕米星 has 14 hydrogen bond donor(s) and 20 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 硫酸异帕米星?
The CAS number of 硫酸异帕米星 is 393574-17-9.
What is the molecular formula of 硫酸异帕米星?
The molecular formula of 硫酸异帕米星 is C22H45N5O16S.
What is the molecular weight of 硫酸异帕米星?
The molecular weight of 硫酸异帕米星 is 667.26 g/mol.
Where can I buy 硫酸异帕米星?
You can request a quote for 硫酸异帕米星 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 硫酸异帕米星?
Yes, KEHONG BIO provides custom synthesis services for 硫酸异帕米星 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.