Reserpine hydrochloride
TL;DR: Reserpine hydrochloride (CAS 16994-56-2) is a chemical compound with molecular formula C33H41ClN2O9 and molecular weight 644.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (15R,18S,20R)-6,18-dimethoxy-17-(3,4,5-trimethoxybenzoyl)oxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylate;hydrochloride
Also Known As: Reserpine hydrochloride, Methyl (3xi)-11,17beta-dimethoxy-18-[(3,4,5-trimethoxybenzoyl)oxy]-15beta-yohimban-16-carboxylate--hydrogen chloride (1/1), Methyl 11,17-dimethoxy-18-[(3,4,5-trimethoxybenzoyl)oxy]yohimban-16-carboxylate--hydrogen chloride (1/1)
| Molecular Formula | C33H41ClN2O9 |
|---|---|
| Molecular Weight | 644.25 g/mol |
| LogP | 4.5929 |
| Topological Polar Surface Area | 117.78 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 8 |
| Exact Mass | 644.25006 |
| Heavy Atoms | 45 |
| Complexity | 1533.4001 |
Chemical Identifiers
| CAS Number | 16994-56-2 |
|---|---|
| SMILES | CO[C@@H]1C(C[C@H]2CN3CCC4=C(C3C[C@H]2C1C(=O)OC)NC5=C4C=CC(=C5)OC)OC(=O)C6=CC(=C(C(=C6)OC)OC)OC.Cl |
Product Overview
Reserpine hydrochloride (CAS 16994-56-2), with molecular formula C33H41ClN2O9 and molecular weight 644.25 g/mol. IUPAC: methyl (15R,18S,20R)-6,18-dimethoxy-17-(3,4,5-trimethoxybenzoyl)oxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylate;hydrochloride.
Chemical Property Profile of Reserpine hydrochloride
Property Insights of Reserpine hydrochloride
The XLogP value of 4.5929 indicates that Reserpine hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 117.78 Ų falls within the moderate polarity range, balancing permeability and solubility for Reserpine hydrochloride. Following Lipinski's Rule of Five, Reserpine hydrochloride has 1 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Reserpine hydrochloride?
The CAS number of Reserpine hydrochloride is 16994-56-2.
What is the molecular formula of Reserpine hydrochloride?
The molecular formula of Reserpine hydrochloride is C33H41ClN2O9.
What is the molecular weight of Reserpine hydrochloride?
The molecular weight of Reserpine hydrochloride is 644.25 g/mol.
Where can I buy Reserpine hydrochloride?
You can request a quote for Reserpine hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Reserpine hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Reserpine hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.