3-脱-O-甲基孢囊菌素A硫酸盐
TL;DR: 3-脱-O-甲基孢囊菌素A硫酸盐 (CAS 82950-18-3) is a chemical compound with molecular formula C16H37N5O13S2 and molecular weight 571.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-脱-O-甲基孢囊菌素A硫酸盐
2-amino-N-[4-amino-3-[3-amino-6-(1-aminoethyl)oxan-2-yl]oxy-2,6-dihydroxycyclohexyl]-N-methylacetamide;sulfuric acid
Also Known As: 3-De-O-methylsporaricin A sulfate, K 4619, K-4619, 2-amino-N-[4-amino-3-[3-amino-6-(1-aminoethyl)oxan-2-yl]oxy-2,6-dihydroxycyclohexyl]-N-methylacetamide;sulfuric acid, 2-amino-N-[4-amino-3-[3-amino-6-(1-aminoethyl)oxan-2-yl]oxy-2,6-dihydroxycyclohexyl]-N-methylacetamide,sulfuric acid
| Molecular Formula | C16H37N5O13S2 |
|---|---|
| Molecular Weight | 571.18 g/mol |
| LogP | -4.5159 |
| Topological Polar Surface Area | 349.0 Ų |
| Hydrogen Bond Donors | 10 |
| Hydrogen Bond Acceptors | 17 |
| Rotatable Bonds | 5 |
| Exact Mass | 571.1829 |
| Heavy Atoms | 36 |
| Complexity | 565.0 |
Chemical Identifiers
| CAS Number | 82950-18-3 |
|---|---|
| SMILES | CC(C1CCC(C(O1)OC2C(CC(C(C2O)N(C)C(=O)CN)O)N)N)N.OS(=O)(=O)O.OS(=O)(=O)O |
| InChIKey | GXEGVOVKMLSAJW-UHFFFAOYSA-N |
Product Overview
3-脱-O-甲基孢囊菌素A硫酸盐 (CAS 82950-18-3), with molecular formula C16H37N5O13S2 and molecular weight 571.18 g/mol. IUPAC: 2-amino-N-[4-amino-3-[3-amino-6-(1-aminoethyl)oxan-2-yl]oxy-2,6-dihydroxycyclohexyl]-N-methylacetamide;sulfuric acid.
Chemical Property Profile of 3-脱-O-甲基孢囊菌素A硫酸盐
Property Insights of 3-脱-O-甲基孢囊菌素A硫酸盐
The XLogP value of -4.5159 indicates that 3-脱-O-甲基孢囊菌素A硫酸盐 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 349.0 Ų indicates high polarity, suggesting 3-脱-O-甲基孢囊菌素A硫酸盐 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 3-脱-O-甲基孢囊菌素A硫酸盐 has 10 hydrogen bond donor(s) and 17 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-脱-O-甲基孢囊菌素A硫酸盐?
The CAS number of 3-脱-O-甲基孢囊菌素A硫酸盐 is 82950-18-3.
What is the molecular formula of 3-脱-O-甲基孢囊菌素A硫酸盐?
The molecular formula of 3-脱-O-甲基孢囊菌素A硫酸盐 is C16H37N5O13S2.
What is the molecular weight of 3-脱-O-甲基孢囊菌素A硫酸盐?
The molecular weight of 3-脱-O-甲基孢囊菌素A硫酸盐 is 571.18 g/mol.
Where can I buy 3-脱-O-甲基孢囊菌素A硫酸盐?
You can request a quote for 3-脱-O-甲基孢囊菌素A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 3-脱-O-甲基孢囊菌素A硫酸盐?
Yes, KEHONG BIO provides custom synthesis services for 3-脱-O-甲基孢囊菌素A硫酸盐 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.