Deserpideine
TL;DR: Deserpideine (CAS 2671-59-2) is a chemical compound with molecular formula C32H36N2O8 and molecular weight 576.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (1R,17R,18R,19S,20R)-18-methoxy-17-(3,4,5-trimethoxybenzoyl)oxy-1,3,11,12,14,17,18,19,20,21-decahydroyohimban-19-carboxylate
Also Known As: Deserpideine, Indole alkaloid, DESERPIDEIN, J2.388.085G, methyl methoxy-(3,4,5-trimethoxybenzoyl)oxy-[?]carboxylate
| Molecular Formula | C32H36N2O8 |
|---|---|
| Molecular Weight | 576.25 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 109.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 9 |
| Exact Mass | 576.2472 |
| Heavy Atoms | 42 |
| Complexity | 1010.0 |
Chemical Identifiers
| CAS Number | 2671-59-2 |
|---|---|
| SMILES | CO[C@H]1[C@@H](C=C2CN3CCC4=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 | RDGOSTXDEPKFIL-NPWMLVFOSA-N |
Product Overview
Deserpideine (CAS 2671-59-2), with molecular formula C32H36N2O8 and molecular weight 576.25 g/mol. IUPAC: methyl (1R,17R,18R,19S,20R)-18-methoxy-17-(3,4,5-trimethoxybenzoyl)oxy-1,3,11,12,14,17,18,19,20,21-decahydroyohimban-19-carboxylate.
Chemical Property Profile of Deserpideine
Property Insights of Deserpideine
The XLogP value of 3.2 indicates that Deserpideine 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 Deserpideine. Following Lipinski's Rule of Five, Deserpideine 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 Deserpideine?
The CAS number of Deserpideine is 2671-59-2.
What is the molecular formula of Deserpideine?
The molecular formula of Deserpideine is C32H36N2O8.
What is the molecular weight of Deserpideine?
The molecular weight of Deserpideine is 576.25 g/mol.
Where can I buy Deserpideine?
You can request a quote for Deserpideine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Deserpideine?
Yes, KEHONG BIO provides custom synthesis services for Deserpideine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.