Albothricin
TL;DR: Albothricin (CAS 103867-06-7) is a chemical compound with molecular formula C20H36N8O7 and molecular weight 500.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[5-(3,6-diaminohexanoylamino)-3-hydroxy-2-(hydroxymethyl)-6-[(5-methyl-4-oxo-3a,6,7,7a-tetrahydro-1H-imidazo[4,5-c]pyridin-2-yl)amino]oxan-4-yl] carbamate
Also Known As: Albothricin, [5-(3,6-diaminohexanoylamino)-3-hydroxy-2-(hydroxymethyl)-6-[(5-methyl-4-oxo-3a,6,7,7a-tetrahydro-1H-imidazo[4,5-c]pyridin-2-yl)amino]oxan-4-yl] carbamate, 4H-Imidazo(4,5-c)pyridin-4-one, 1,3a,5,6,7,7a-hexahydro-2-((4-O-(aminocarbonyl)-2-deoxy-2-((3,6-diamino-1-oxohexyl)amino)-beta-D-gulopyranosyl)amino)-5-methyl-, (3aS-(2(R*),3a-alpha,7a-beta))-, 4H-Imidazo(4,5-c)pyridin-4-one, 2-((4-O-(aminocarbonyl)-2-deoxy-2-((3,6-diamino-1-oxohexyl)amino)-beta-D-gulopyranosyl)amino)-1,3a,5,6,7,7a-hexahydro-5-methyl-, (3aS-(2(R*),3aalpha,7abeta))-, (5-(3,6-diaminohexanoylamino)-3-hydroxy-2-(hydroxymethyl)-6-((5-methyl-4-oxo-3a,6,7,7a-tetrahydro-1H-imidazo(4,5-c)pyridin-2-yl)amino)oxan-4-yl) carbamate
| Molecular Formula | C20H36N8O7 |
|---|---|
| Molecular Weight | 500.27 g/mol |
| LogP | -3.8 |
| Topological Polar Surface Area | 240.0 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 11 |
| Exact Mass | 500.2707 |
| Heavy Atoms | 35 |
| Complexity | 814.0 |
Chemical Identifiers
| CAS Number | 103867-06-7 |
|---|---|
| SMILES | CN1CCC2C(C1=O)N=C(N2)NC3C(C(C(C(O3)CO)O)OC(=O)N)NC(=O)CC(CCCN)N |
| InChIKey | UPTGLQHELMHPNC-UHFFFAOYSA-N |
Product Overview
Albothricin (CAS 103867-06-7), with molecular formula C20H36N8O7 and molecular weight 500.27 g/mol. IUPAC: [5-(3,6-diaminohexanoylamino)-3-hydroxy-2-(hydroxymethyl)-6-[(5-methyl-4-oxo-3a,6,7,7a-tetrahydro-1H-imidazo[4,5-c]pyridin-2-yl)amino]oxan-4-yl] carbamate.
Chemical Property Profile of Albothricin
Property Insights of Albothricin
The XLogP value of -3.8 indicates that Albothricin is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 240.0 Ų indicates high polarity, suggesting Albothricin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Albothricin has 8 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Albothricin?
The CAS number of Albothricin is 103867-06-7.
What is the molecular formula of Albothricin?
The molecular formula of Albothricin is C20H36N8O7.
What is the molecular weight of Albothricin?
The molecular weight of Albothricin is 500.27 g/mol.
Where can I buy Albothricin?
You can request a quote for Albothricin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Albothricin?
Yes, KEHONG BIO provides custom synthesis services for Albothricin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.