异帕米星二硫酸盐
TL;DR: 异帕米星二硫酸盐 (CAS 68000-78-2) is a chemical compound with molecular formula C22H47N5O20S2 and molecular weight 765.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
异帕米星二硫酸盐
(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 disulfate, Isepamycin sulfate, isepamicin sulfate, D-Streptamine, O-6-amino-6-deoxy-alpha-D-glucopyranosyl-(1-4)-O-(3-deoxy-4-C-methyl-3-(methylamino)-beta-L-arabinopyranosyl-(1-6))-N(sup 1)-(3-amino-2-hydroxy-1-oxopropyl)-2-deoxy-, (S)-, sulfate (1:2) (salt), (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
| Molecular Formula | C22H47N5O20S2 |
|---|---|
| Molecular Weight | 765.23 g/mol |
| LogP | -8.83 |
| Topological Polar Surface Area | 464.0 Ų |
| Hydrogen Bond Donors | 16 |
| Hydrogen Bond Acceptors | 24 |
| Rotatable Bonds | 9 |
| Exact Mass | 765.2256 |
| Heavy Atoms | 49 |
| Complexity | 899.0 |
Chemical Identifiers
| CAS Number | 68000-78-2 |
|---|---|
| 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.OS(=O)(=O)O |
| InChIKey | KENHPEYNCGCZOF-XZWSBQPUSA-N |
Product Overview
异帕米星二硫酸盐 (CAS 68000-78-2), with molecular formula C22H47N5O20S2 and molecular weight 765.23 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 异帕米星二硫酸盐
Property Insights of 异帕米星二硫酸盐
The XLogP value of -8.83 indicates that 异帕米星二硫酸盐 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 464.0 Ų indicates high polarity, suggesting 异帕米星二硫酸盐 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 异帕米星二硫酸盐 has 16 hydrogen bond donor(s) and 24 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 异帕米星二硫酸盐?
The CAS number of 异帕米星二硫酸盐 is 68000-78-2.
What is the molecular formula of 异帕米星二硫酸盐?
The molecular formula of 异帕米星二硫酸盐 is C22H47N5O20S2.
What is the molecular weight of 异帕米星二硫酸盐?
The molecular weight of 异帕米星二硫酸盐 is 765.23 g/mol.
Where can I buy 异帕米星二硫酸盐?
You can request a quote for 异帕米星二硫酸盐 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 异帕米星二硫酸盐?
Yes, KEHONG BIO provides custom synthesis services for 异帕米星二硫酸盐 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.