Psychotrine
TL;DR: Psychotrine (CAS 7633-29-6) is a chemical compound with molecular formula C28H36N2O4 and molecular weight 464.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[[(2R,3R,11bS)-3-ethyl-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizin-2-yl]methyl]-7-methoxy-3,4-dihydroisoquinolin-6-ol
Also Known As: Psychotrine, Isoquinoline alkaloid, PSYCHOTRINE [MI], Emetan-6'-ol, 1',2'-didehydro-7',10,11-trimethoxy-, 1',2'-Didehydro-7',10,11-trimethoxyemetan-6'-ol
| Molecular Formula | C28H36N2O4 |
|---|---|
| Molecular Weight | 464.27 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 63.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 464.26752 |
| Heavy Atoms | 34 |
| Complexity | 717.0 |
Chemical Identifiers
| CAS Number | 7633-29-6 |
|---|---|
| SMILES | CC[C@H]1CN2CCC3=CC(=C(C=C3[C@@H]2C[C@@H]1CC4=NCCC5=CC(=C(C=C54)OC)O)OC)OC |
| InChIKey | NCALAYAMQHIWMN-REIDKSKDSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Psychotrine (CAS 7633-29-6), with molecular formula C28H36N2O4 and molecular weight 464.27 g/mol. IUPAC: 1-[[(2R,3R,11bS)-3-ethyl-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizin-2-yl]methyl]-7-methoxy-3,4-dihydroisoquinolin-6-ol.
Chemical Property Profile of Psychotrine
Property Insights of Psychotrine
The XLogP value of 4.3 indicates that Psychotrine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Psychotrine. Following Lipinski's Rule of Five, Psychotrine has 1 hydrogen bond donor(s) and 6 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 Psychotrine?
The CAS number of Psychotrine is 7633-29-6.
What is the molecular formula of Psychotrine?
The molecular formula of Psychotrine is C28H36N2O4.
What is the molecular weight of Psychotrine?
The molecular weight of Psychotrine is 464.27 g/mol.
Where can I buy Psychotrine?
You can request a quote for Psychotrine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Psychotrine?
Yes, KEHONG BIO provides custom synthesis services for Psychotrine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.