XX-88-5 trisulfate
TL;DR: XX-88-5 trisulfate (CAS 56276-27-8) is a chemical compound with molecular formula C18H44N6O19S3 and molecular weight 744.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-amino-6-(aminomethyl)-2-[4,6-diamino-3-(3,4-diamino-5-methoxyoxan-2-yl)oxy-2-hydroxycyclohexyl]oxyoxan-4-ol;sulfuric acid
Also Known As: XX-88-5 trisulfate, Antibiotic XK 88-5 trisulfate, Seldomycin factor 5 trisulfate, D-Streptamine, O-2,3-diamino-2,3-dideoxy-4-O-methyl-alpha-D-xylopyranosyl-(1-6)-O-(2,6-diamino-2,4,6-trideoxy-alpha-D-xylo-hexopyranosyl-(1-4))-2-deoxy-, sulfate (1:3), 3-amino-6-(aminomethyl)-2-[4,6-diamino-3-(3,4-diamino-5-methoxyoxan-2-yl)oxy-2-hydroxycyclohexyl]oxyoxan-4-ol; sulfuric acid
| Molecular Formula | C18H44N6O19S3 |
|---|---|
| Molecular Weight | 744.18 g/mol |
| LogP | -6.9946 |
| Topological Polar Surface Area | 466.53 Ų |
| Hydrogen Bond Donors | 14 |
| Hydrogen Bond Acceptors | 19 |
| Rotatable Bonds | 6 |
| Exact Mass | 744.1823 |
| Heavy Atoms | 46 |
| Complexity | 1121.0101 |
Chemical Identifiers
| CAS Number | 56276-27-8 |
|---|---|
| SMILES | COC1COC(C(C1N)N)OC2C(CC(C(C2O)OC3C(C(CC(O3)CN)O)N)N)N.OS(=O)(=O)O.OS(=O)(=O)O.OS(=O)(=O)O |
Product Overview
XX-88-5 trisulfate (CAS 56276-27-8), with molecular formula C18H44N6O19S3 and molecular weight 744.18 g/mol. IUPAC: 3-amino-6-(aminomethyl)-2-[4,6-diamino-3-(3,4-diamino-5-methoxyoxan-2-yl)oxy-2-hydroxycyclohexyl]oxyoxan-4-ol;sulfuric acid.
Chemical Property Profile of XX-88-5 trisulfate
Property Insights of XX-88-5 trisulfate
The XLogP value of -6.9946 indicates that XX-88-5 trisulfate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 466.53 Ų indicates high polarity, suggesting XX-88-5 trisulfate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, XX-88-5 trisulfate has 14 hydrogen bond donor(s) and 19 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of XX-88-5 trisulfate?
The CAS number of XX-88-5 trisulfate is 56276-27-8.
What is the molecular formula of XX-88-5 trisulfate?
The molecular formula of XX-88-5 trisulfate is C18H44N6O19S3.
What is the molecular weight of XX-88-5 trisulfate?
The molecular weight of XX-88-5 trisulfate is 744.18 g/mol.
Where can I buy XX-88-5 trisulfate?
You can request a quote for XX-88-5 trisulfate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for XX-88-5 trisulfate?
Yes, KEHONG BIO provides custom synthesis services for XX-88-5 trisulfate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.