柯楠次碱
TL;DR: 柯楠次碱 (CAS 483-10-3) is a chemical compound with molecular formula C21H26N2O3 and molecular weight 354.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
柯楠次碱
methyl (1S,15R,18S,19S,20S)-18-hydroxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylate
Also Known As: corynanthine, Rauhimbine, Rauhimbin, Corynanthin, Corynantheine
| Molecular Formula | C21H26N2O3 |
|---|---|
| Molecular Weight | 354.19 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 65.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 354.19434 |
| Heavy Atoms | 26 |
| Complexity | 555.0 |
| Solubility | >53.2 [ug/mL] (The mean of the results at pH 7.4) |
Chemical Identifiers
| CAS Number | 483-10-3 |
|---|---|
| SMILES | COC(=O)[C@@H]1[C@H](CC[C@@H]2[C@@H]1C[C@H]3C4=C(CCN3C2)C5=CC=CC=C5N4)O |
| InChIKey | BLGXFZZNTVWLAY-DKJBZYCGSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
柯楠次碱 (CAS 483-10-3), with molecular formula C21H26N2O3 and molecular weight 354.19 g/mol. IUPAC: methyl (1S,15R,18S,19S,20S)-18-hydroxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylate.
Chemical Property Profile of 柯楠次碱
Property Insights of 柯楠次碱
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 柯楠次碱. The TPSA of 65.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 柯楠次碱. Following Lipinski's Rule of Five, 柯楠次碱 has 2 hydrogen bond donor(s) and 4 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 柯楠次碱?
The CAS number of 柯楠次碱 is 483-10-3.
What is the molecular formula of 柯楠次碱?
The molecular formula of 柯楠次碱 is C21H26N2O3.
What is the molecular weight of 柯楠次碱?
The molecular weight of 柯楠次碱 is 354.19 g/mol.
Where can I buy 柯楠次碱?
You can request a quote for 柯楠次碱 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 柯楠次碱?
Yes, KEHONG BIO provides custom synthesis services for 柯楠次碱 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.