Epivolkenin
TL;DR: Epivolkenin (CAS 109905-56-8) is a chemical compound with molecular formula C12H17NO7 and molecular weight 287.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S)-4-hydroxy-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxycyclopent-2-ene-1-carbonitrile
Also Known As: Epivolkenin, Passicoriacin, Tetraphyllin B, 2-Cyclopentene-1-carbonitrile, (1S-cis), (1S)-4-hydroxy-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxycyclopent-2-ene-1-carbonitrile
| Molecular Formula | C12H17NO7 |
|---|---|
| Molecular Weight | 287.10 g/mol |
| LogP | -2.61392 |
| Topological Polar Surface Area | 143.4 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 287.1005 |
| Heavy Atoms | 20 |
| Complexity | 420.51913 |
Chemical Identifiers
| CAS Number | 109905-56-8 |
|---|---|
| SMILES | C1C(C=C[C@@]1(C#N)OC2C(C(C(C(O2)CO)O)O)O)O |
Product Overview
Epivolkenin (CAS 109905-56-8), with molecular formula C12H17NO7 and molecular weight 287.10 g/mol. IUPAC: (1S)-4-hydroxy-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxycyclopent-2-ene-1-carbonitrile.
Chemical Property Profile of Epivolkenin
Property Insights of Epivolkenin
The XLogP value of -2.61392 indicates that Epivolkenin is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 143.4 Ų indicates high polarity, suggesting Epivolkenin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Epivolkenin has 5 hydrogen bond donor(s) and 8 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 Epivolkenin?
The CAS number of Epivolkenin is 109905-56-8.
What is the molecular formula of Epivolkenin?
The molecular formula of Epivolkenin is C12H17NO7.
What is the molecular weight of Epivolkenin?
The molecular weight of Epivolkenin is 287.10 g/mol.
Where can I buy Epivolkenin?
You can request a quote for Epivolkenin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Epivolkenin?
Yes, KEHONG BIO provides custom synthesis services for Epivolkenin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.