Siseptin
TL;DR: Siseptin (CAS 53179-09-2) is a chemical compound with molecular formula C19H39N5O11S and molecular weight 545.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R,3R,4R,5R)-2-[(1S,2S,3R,4S,6R)-4,6-diamino-3-[[(2S,3R)-3-amino-6-(aminomethyl)-3,4-dihydro-2H-pyran-2-yl]oxy]-2-hydroxycyclohexyl]oxy-5-methyl-4-(methylamino)oxane-3,5-diol;sulfuric acid
Also Known As: Siseptin, Sisomicin sulfate, Extramycin, Pathomycin, Baymicine
| Molecular Formula | C19H39N5O11S |
|---|---|
| Molecular Weight | 545.24 g/mol |
| LogP | -4.5 |
| Topological Polar Surface Area | 297.0 Ų |
| Hydrogen Bond Donors | 10 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 6 |
| Exact Mass | 545.2367 |
| Heavy Atoms | 36 |
| Complexity | 724.0 |
Chemical Identifiers
| CAS Number | 53179-09-2 |
|---|---|
| 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](CC=C(O3)CN)N)N)N)O.OS(=O)(=O)O |
| InChIKey | JVTNJDPXUPRGIE-XMKQNZKISA-N |
Product Overview
Siseptin (CAS 53179-09-2), with molecular formula C19H39N5O11S and molecular weight 545.24 g/mol. IUPAC: (2R,3R,4R,5R)-2-[(1S,2S,3R,4S,6R)-4,6-diamino-3-[[(2S,3R)-3-amino-6-(aminomethyl)-3,4-dihydro-2H-pyran-2-yl]oxy]-2-hydroxycyclohexyl]oxy-5-methyl-4-(methylamino)oxane-3,5-diol;sulfuric acid.
Chemical Property Profile of Siseptin
Property Insights of Siseptin
The XLogP value of -4.5 indicates that Siseptin is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 297.0 Ų indicates high polarity, suggesting Siseptin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Siseptin has 10 hydrogen bond donor(s) and 16 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Siseptin?
The CAS number of Siseptin is 53179-09-2.
What is the molecular formula of Siseptin?
The molecular formula of Siseptin is C19H39N5O11S.
What is the molecular weight of Siseptin?
The molecular weight of Siseptin is 545.24 g/mol.
Where can I buy Siseptin?
You can request a quote for Siseptin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Siseptin?
Yes, KEHONG BIO provides custom synthesis services for Siseptin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.