(+)-Mesembrine
TL;DR: (+)-Mesembrine (CAS 6023-73-0) is a chemical compound with molecular formula C17H23NO3 and molecular weight 289.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3aR,7aR)-3a-(3,4-dimethoxyphenyl)-1-methyl-2,3,4,5,7,7a-hexahydroindol-6-one
Also Known As: Mesembrine, (+)-Mesembrine, Mesembranone, Mesembrin, Mesembrine [MI]
| Molecular Formula | C17H23NO3 |
|---|---|
| Molecular Weight | 289.17 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 38.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 289.1678 |
| Heavy Atoms | 21 |
| Complexity | 399.0 |
Chemical Identifiers
| CAS Number | 6023-73-0 |
|---|---|
| SMILES | CN1CC[C@@]2([C@H]1CC(=O)CC2)C3=CC(=C(C=C3)OC)OC |
| InChIKey | DAHIQPJTGIHDGO-IAGOWNOFSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(+)-Mesembrine (CAS 6023-73-0), with molecular formula C17H23NO3 and molecular weight 289.17 g/mol. IUPAC: (3aR,7aR)-3a-(3,4-dimethoxyphenyl)-1-methyl-2,3,4,5,7,7a-hexahydroindol-6-one.
Chemical Property Profile of (+)-Mesembrine
Property Insights of (+)-Mesembrine
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (+)-Mesembrine. With a topological polar surface area (TPSA) of 38.8 Ų, (+)-Mesembrine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (+)-Mesembrine has 0 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 (+)-Mesembrine?
The CAS number of (+)-Mesembrine is 6023-73-0.
What is the molecular formula of (+)-Mesembrine?
The molecular formula of (+)-Mesembrine is C17H23NO3.
What is the molecular weight of (+)-Mesembrine?
The molecular weight of (+)-Mesembrine is 289.17 g/mol.
Where can I buy (+)-Mesembrine?
You can request a quote for (+)-Mesembrine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (+)-Mesembrine?
Yes, KEHONG BIO provides custom synthesis services for (+)-Mesembrine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.