16,18-Reserpinediol
TL;DR: 16,18-Reserpinediol (CAS 482-98-4) is a chemical compound with molecular formula C22H30N2O4 and molecular weight 386.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1R,15S,17R,18R,19R,20S)-19-(hydroxymethyl)-6,18-dimethoxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-17-ol
Also Known As: Reserpinediol, Reserpic alcohol, 16,18-Reserpinediol, 16-(Hydroxymethyl)-11,17-dimethoxyyohimban-18-ol, Yohimban-16-methanol, 18-hydroxy-11,17-dimethoxy-, (3beta,16beta,17alpha,18beta,20alpha)-
| Molecular Formula | C22H30N2O4 |
|---|---|
| Molecular Weight | 386.22 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 78.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 386.22055 |
| Heavy Atoms | 28 |
| Complexity | 563.0 |
Chemical Identifiers
| CAS Number | 482-98-4 |
|---|---|
| SMILES | CO[C@H]1[C@@H](C[C@@H]2CN3CCC4=C([C@H]3C[C@@H]2[C@@H]1CO)NC5=C4C=CC(=C5)OC)O |
| InChIKey | YCLAQLTVHNAEEQ-UALTWCDSSA-N |
Product Overview
16,18-Reserpinediol (CAS 482-98-4), with molecular formula C22H30N2O4 and molecular weight 386.22 g/mol. IUPAC: (1R,15S,17R,18R,19R,20S)-19-(hydroxymethyl)-6,18-dimethoxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-17-ol.
Chemical Property Profile of 16,18-Reserpinediol
Property Insights of 16,18-Reserpinediol
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 16,18-Reserpinediol. The TPSA of 78.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 16,18-Reserpinediol. Following Lipinski's Rule of Five, 16,18-Reserpinediol has 3 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 16,18-Reserpinediol?
The CAS number of 16,18-Reserpinediol is 482-98-4.
What is the molecular formula of 16,18-Reserpinediol?
The molecular formula of 16,18-Reserpinediol is C22H30N2O4.
What is the molecular weight of 16,18-Reserpinediol?
The molecular weight of 16,18-Reserpinediol is 386.22 g/mol.
Where can I buy 16,18-Reserpinediol?
You can request a quote for 16,18-Reserpinediol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 16,18-Reserpinediol?
Yes, KEHONG BIO provides custom synthesis services for 16,18-Reserpinediol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.