Sarmentosin epoxide
TL;DR: Sarmentosin epoxide (CAS 81907-02-0) is a chemical compound with molecular formula C11H17NO8 and molecular weight 291.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(hydroxymethyl)-3-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxirane-2-carbonitrile
Also Known As: Sarmentosin epoxide, J2.765.666H, 2-(hydroxymethyl)-3-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxirane-2-carbonitrile, 2-(hydroxymethyl)-3-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxymethyl]oxirane-2-carbonitrile, 3-[(beta-D-Glucopyranosyloxy)methyl]-2-(hydroxymethyl)oxiranecarbonitrile
| Molecular Formula | C11H17NO8 |
|---|---|
| Molecular Weight | 291.10 g/mol |
| LogP | -3.4 |
| Topological Polar Surface Area | 156.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 5 |
| Exact Mass | 291.09543 |
| Heavy Atoms | 20 |
| Complexity | 397.0 |
Chemical Identifiers
| CAS Number | 81907-02-0 |
|---|---|
| SMILES | C([C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)OCC2C(O2)(CO)C#N)O)O)O)O |
| InChIKey | MGWCXJDKHMCXRL-YMGPVYFXSA-N |
Product Overview
Sarmentosin epoxide (CAS 81907-02-0), with molecular formula C11H17NO8 and molecular weight 291.10 g/mol. IUPAC: 2-(hydroxymethyl)-3-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxirane-2-carbonitrile.
Chemical Property Profile of Sarmentosin epoxide
Property Insights of Sarmentosin epoxide
The XLogP value of -3.4 indicates that Sarmentosin epoxide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 156.0 Ų indicates high polarity, suggesting Sarmentosin epoxide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Sarmentosin epoxide has 5 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Sarmentosin epoxide?
The CAS number of Sarmentosin epoxide is 81907-02-0.
What is the molecular formula of Sarmentosin epoxide?
The molecular formula of Sarmentosin epoxide is C11H17NO8.
What is the molecular weight of Sarmentosin epoxide?
The molecular weight of Sarmentosin epoxide is 291.10 g/mol.
Where can I buy Sarmentosin epoxide?
You can request a quote for Sarmentosin epoxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Sarmentosin epoxide?
Yes, KEHONG BIO provides custom synthesis services for Sarmentosin epoxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.