Deserpidine
TL;DR: Deserpidine (CAS 131-01-1) is a chemical compound with molecular formula C32H38N2O8 and molecular weight 578.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (1R,15S,17R,18R,19S,20S)-18-methoxy-17-(3,4,5-trimethoxybenzoyl)oxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylate
Also Known As: DESERPIDINE, Harmonyl, Raunormine, Recanescine, Recanescin
| Molecular Formula | C32H38N2O8 |
|---|---|
| Molecular Weight | 578.26 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 109.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 9 |
| Exact Mass | 578.2628 |
| Heavy Atoms | 42 |
| Complexity | 953.0 |
| Melting Point | 228-232 |
| Solubility | 1.11e-02 g/L |
Chemical Identifiers
| CAS Number | 131-01-1 |
|---|---|
| SMILES | CO[C@H]1[C@@H](C[C@@H]2CN3CCC4=C([C@H]3C[C@@H]2[C@@H]1C(=O)OC)NC5=CC=CC=C45)OC(=O)C6=CC(=C(C(=C6)OC)OC)OC |
| InChIKey | CVBMAZKKCSYWQR-WCGOZPBSSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Deserpidine (CAS 131-01-1), with molecular formula C32H38N2O8 and molecular weight 578.26 g/mol. IUPAC: methyl (1R,15S,17R,18R,19S,20S)-18-methoxy-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 Deserpidine
Property Insights of Deserpidine
The XLogP value of 4.1 indicates that Deserpidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 109.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Deserpidine. Following Lipinski's Rule of Five, Deserpidine has 1 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Deserpidine?
The CAS number of Deserpidine is 131-01-1.
What is the molecular formula of Deserpidine?
The molecular formula of Deserpidine is C32H38N2O8.
What is the molecular weight of Deserpidine?
The molecular weight of Deserpidine is 578.26 g/mol.
Where can I buy Deserpidine?
You can request a quote for Deserpidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Deserpidine?
Yes, KEHONG BIO provides custom synthesis services for Deserpidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.