18-Hydroxy-11,17-dimethoxyyohimban-16-carboxylic acid
TL;DR: 18-Hydroxy-11,17-dimethoxyyohimban-16-carboxylic acid (CAS 687641-10-7) is a chemical compound with molecular formula C22H28N2O5 and molecular weight 400.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
17-hydroxy-6,18-dimethoxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylic acid
Also Known As: Reserpic acid, Reserpinolic acid, Reserpinic acid hydrochloride, hydroxy(dimethoxy)[?]carboxylic acid, 18-hydroxy-11,17-dimethoxyyohimban-16-carboxylic acid
| Molecular Formula | C22H28N2O5 |
|---|---|
| Molecular Weight | 400.20 g/mol |
| LogP | -0.7 |
| Topological Polar Surface Area | 95.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 400.19983 |
| Heavy Atoms | 29 |
| Complexity | 632.0 |
Chemical Identifiers
| CAS Number | 687641-10-7 |
|---|---|
| SMILES | COC1C(CC2CN3CCC4=C(C3CC2C1C(=O)O)NC5=C4C=CC(=C5)OC)O |
| InChIKey | JVHNBFFHWQQPLL-UHFFFAOYSA-N |
Product Overview
18-Hydroxy-11,17-dimethoxyyohimban-16-carboxylic acid (CAS 687641-10-7), with molecular formula C22H28N2O5 and molecular weight 400.20 g/mol. IUPAC: 17-hydroxy-6,18-dimethoxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylic acid.
Chemical Property Profile of 18-Hydroxy-11,17-dimethoxyyohimban-16-carboxylic acid
Property Insights of 18-Hydroxy-11,17-dimethoxyyohimban-16-carboxylic acid
The XLogP value of -0.7 indicates that 18-Hydroxy-11,17-dimethoxyyohimban-16-carboxylic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 95.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 18-Hydroxy-11,17-dimethoxyyohimban-16-carboxylic acid. Following Lipinski's Rule of Five, 18-Hydroxy-11,17-dimethoxyyohimban-16-carboxylic acid has 3 hydrogen bond donor(s) and 6 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 18-Hydroxy-11,17-dimethoxyyohimban-16-carboxylic acid?
The CAS number of 18-Hydroxy-11,17-dimethoxyyohimban-16-carboxylic acid is 687641-10-7.
What is the molecular formula of 18-Hydroxy-11,17-dimethoxyyohimban-16-carboxylic acid?
The molecular formula of 18-Hydroxy-11,17-dimethoxyyohimban-16-carboxylic acid is C22H28N2O5.
What is the molecular weight of 18-Hydroxy-11,17-dimethoxyyohimban-16-carboxylic acid?
The molecular weight of 18-Hydroxy-11,17-dimethoxyyohimban-16-carboxylic acid is 400.20 g/mol.
Where can I buy 18-Hydroxy-11,17-dimethoxyyohimban-16-carboxylic acid?
You can request a quote for 18-Hydroxy-11,17-dimethoxyyohimban-16-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 18-Hydroxy-11,17-dimethoxyyohimban-16-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 18-Hydroxy-11,17-dimethoxyyohimban-16-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.