Allosamidin
TL;DR: Allosamidin (CAS 103782-08-7) is a chemical compound with molecular formula C25H42N4O14 and molecular weight 622.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(2S,3R,4S,5S,6R)-2-[(2R,3S,4S,5R,6R)-6-[[(3aR,4R,5R,6S,6aS)-2-(dimethylamino)-4-hydroxy-6-(hydroxymethyl)-4,5,6,6a-tetrahydro-3aH-cyclopenta[d][1,3]oxazol-5-yl]oxy]-5-acetamido-4-hydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide
Also Known As: Allosamidin, Allosamidine, (-)-ALLOSAMIDIN, ALLOSAMIDIN [ISO], (-)-ALLOSAMIDINE
| Molecular Formula | C25H42N4O14 |
|---|---|
| Molecular Weight | 622.27 g/mol |
| LogP | -5.7 |
| Topological Polar Surface Area | 262.0 Ų |
| Hydrogen Bond Donors | 9 |
| Hydrogen Bond Acceptors | 15 |
| Rotatable Bonds | 10 |
| Exact Mass | 622.2698 |
| Heavy Atoms | 43 |
| Complexity | 1020.0 |
Chemical Identifiers
| CAS Number | 103782-08-7 |
|---|---|
| SMILES | CC(=O)N[C@@H]1[C@@H]([C@@H]([C@H](O[C@H]1O[C@@H]2[C@H](O[C@H]([C@@H]([C@@H]2O)NC(=O)C)O[C@@H]3[C@H]([C@H]4[C@@H]([C@H]3O)N=C(O4)N(C)C)CO)CO)CO)O)O |
| InChIKey | MDWNFWDBQGOKNZ-XYUDZHFQSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Allosamidin (CAS 103782-08-7), with molecular formula C25H42N4O14 and molecular weight 622.27 g/mol. IUPAC: N-[(2S,3R,4S,5S,6R)-2-[(2R,3S,4S,5R,6R)-6-[[(3aR,4R,5R,6S,6aS)-2-(dimethylamino)-4-hydroxy-6-(hydroxymethyl)-4,5,6,6a-tetrahydro-3aH-cyclopenta[d][1,3]oxazol-5-yl]oxy]-5-acetamido-4-hydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide.
Chemical Property Profile of Allosamidin
Property Insights of Allosamidin
The XLogP value of -5.7 indicates that Allosamidin is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 262.0 Ų indicates high polarity, suggesting Allosamidin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Allosamidin has 9 hydrogen bond donor(s) and 15 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Allosamidin?
The CAS number of Allosamidin is 103782-08-7.
What is the molecular formula of Allosamidin?
The molecular formula of Allosamidin is C25H42N4O14.
What is the molecular weight of Allosamidin?
The molecular weight of Allosamidin is 622.27 g/mol.
Where can I buy Allosamidin?
You can request a quote for Allosamidin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Allosamidin?
Yes, KEHONG BIO provides custom synthesis services for Allosamidin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.