Glucoallosamidin B
TL;DR: Glucoallosamidin B (CAS 136196-62-8) 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-[2-[5-acetamido-4-hydroxy-6-[[4-hydroxy-6-(hydroxymethyl)-2-(methylamino)-4,5,6,6a-tetrahydro-3aH-cyclopenta[d][1,3]oxazol-5-yl]oxy]-2-(hydroxymethyl)oxan-3-yl]oxy-4,5-dihydroxy-6-(methoxymethyl)oxan-3-yl]acetamide
Also Known As: Glucoallosamidin B, Methyl-N-demethylallosamidin
| Molecular Formula | C25H42N4O14 |
|---|---|
| Molecular Weight | 622.27 g/mol |
| LogP | -5.9 |
| Topological Polar Surface Area | 259.0 Ų |
| Hydrogen Bond Donors | 9 |
| Hydrogen Bond Acceptors | 15 |
| Rotatable Bonds | 11 |
| Exact Mass | 622.2698 |
| Heavy Atoms | 43 |
| Complexity | 1010.0 |
Chemical Identifiers
| CAS Number | 136196-62-8 |
|---|---|
| SMILES | CC(=O)NC1C(C(C(OC1OC2C(OC(C(C2O)NC(=O)C)OC3C(C4C(C3O)N=C(O4)NC)CO)CO)COC)O)O |
| InChIKey | MJUOPNSEEIKMFW-UHFFFAOYSA-N |
Product Overview
Glucoallosamidin B (CAS 136196-62-8), with molecular formula C25H42N4O14 and molecular weight 622.27 g/mol. IUPAC: N-[2-[5-acetamido-4-hydroxy-6-[[4-hydroxy-6-(hydroxymethyl)-2-(methylamino)-4,5,6,6a-tetrahydro-3aH-cyclopenta[d][1,3]oxazol-5-yl]oxy]-2-(hydroxymethyl)oxan-3-yl]oxy-4,5-dihydroxy-6-(methoxymethyl)oxan-3-yl]acetamide.
Chemical Property Profile of Glucoallosamidin B
Property Insights of Glucoallosamidin B
The XLogP value of -5.9 indicates that Glucoallosamidin B is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 259.0 Ų indicates high polarity, suggesting Glucoallosamidin B may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Glucoallosamidin B 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 Glucoallosamidin B?
The CAS number of Glucoallosamidin B is 136196-62-8.
What is the molecular formula of Glucoallosamidin B?
The molecular formula of Glucoallosamidin B is C25H42N4O14.
What is the molecular weight of Glucoallosamidin B?
The molecular weight of Glucoallosamidin B is 622.27 g/mol.
Where can I buy Glucoallosamidin B?
You can request a quote for Glucoallosamidin B directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Glucoallosamidin B?
Yes, KEHONG BIO provides custom synthesis services for Glucoallosamidin B and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.