Venenatine
TL;DR: Venenatine (CAS 1055-75-0) is a chemical compound with molecular formula C22H28N2O4 and molecular weight 384.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (1R,15S,18R,19S,20S)-18-hydroxy-8-methoxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylate
Also Known As: Venenatine, Venenatine methiodide, methyl hydroxy(methoxy)[?]carboxylate, methyl(3, A,16
| Molecular Formula | C22H28N2O4 |
|---|---|
| Molecular Weight | 384.20 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 74.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 384.2049 |
| Heavy Atoms | 28 |
| Complexity | 601.0 |
Chemical Identifiers
| CAS Number | 1055-75-0 |
|---|---|
| SMILES | COC1=CC=CC2=C1C3=C(N2)[C@H]4C[C@H]5[C@H](CC[C@H]([C@H]5C(=O)OC)O)CN4CC3 |
| InChIKey | WMMZYEBFJWWUJX-YCSGKXEJSA-N |
Product Overview
Venenatine (CAS 1055-75-0), with molecular formula C22H28N2O4 and molecular weight 384.20 g/mol. IUPAC: methyl (1R,15S,18R,19S,20S)-18-hydroxy-8-methoxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylate.
Chemical Property Profile of Venenatine
Property Insights of Venenatine
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Venenatine. The TPSA of 74.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Venenatine. Following Lipinski's Rule of Five, Venenatine has 2 hydrogen bond donor(s) and 5 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 Venenatine?
The CAS number of Venenatine is 1055-75-0.
What is the molecular formula of Venenatine?
The molecular formula of Venenatine is C22H28N2O4.
What is the molecular weight of Venenatine?
The molecular weight of Venenatine is 384.20 g/mol.
Where can I buy Venenatine?
You can request a quote for Venenatine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Venenatine?
Yes, KEHONG BIO provides custom synthesis services for Venenatine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.