利血平
TL;DR: 利血平 (CAS 50-55-5) is a chemical compound with molecular formula C33H40N2O9 and molecular weight 608.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
利血平
methyl 6,18-dimethoxy-17-(3,4,5-trimethoxybenzoyl)oxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylate
Also Known As: reserpine, Isoreserpin, Salutensin, Benazyl, (-)-Isoreserpine
| Molecular Formula | C33H40N2O9 |
|---|---|
| Molecular Weight | 608.27 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 118.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 10 |
| Exact Mass | 608.2734 |
| Heavy Atoms | 44 |
| Complexity | 1000.0 |
Chemical Identifiers
| CAS Number | 50-55-5 |
|---|---|
| SMILES | COC1C(CC2CN3CCC4=C(C3CC2C1C(=O)OC)NC5=C4C=CC(=C5)OC)OC(=O)C6=CC(=C(C(=C6)OC)OC)OC |
| InChIKey | QEVHRUUCFGRFIF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
利血平 (CAS 50-55-5), with molecular formula C33H40N2O9 and molecular weight 608.27 g/mol. IUPAC: methyl 6,18-dimethoxy-17-(3,4,5-trimethoxybenzoyl)oxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylate.
Chemical Property Profile of 利血平
Property Insights of 利血平
The XLogP value of 4.0 indicates that 利血平 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 118.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 利血平. Following Lipinski's Rule of Five, 利血平 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 利血平?
The CAS number of 利血平 is 50-55-5.
What is the molecular formula of 利血平?
The molecular formula of 利血平 is C33H40N2O9.
What is the molecular weight of 利血平?
The molecular weight of 利血平 is 608.27 g/mol.
Where can I buy 利血平?
You can request a quote for 利血平 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 利血平?
Yes, KEHONG BIO provides custom synthesis services for 利血平 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.