9-O-ethyl lycorenine
TL;DR: 9-O-ethyl lycorenine (CAS 75917-42-9) is a chemical compound with molecular formula C20H28ClNO4 and molecular weight 381.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5aR,7S,11bS,11cS)-7-ethoxy-9,10-dimethoxy-1-methyl-3,5,5a,7,11b,11c-hexahydro-2H-isochromeno[3,4-g]indole;hydrochloride
Also Known As: 9-O-Ethyl lycorenine, 9-O-Ethyl lycorenine hydrochloride, Lycorenan, 7-ethoxy-9,10-dimethoxy-1-methyl-, hydrochloride, (7alpha)-, 9,10-Dimethoxy-7-ethoxy-1-methyl-1,2,3,5a,7,11b,11c-octahydro(2)benzopyrano(3,4-g)indole HCl, (2)Benzopyrano(3,4-g)indole, 1,2,3,5a,7,11b,11c-octahydro-9,10-dimethoxy-7-ethoxy-1-methyl-, hydrochloride
| Molecular Formula | C20H28ClNO4 |
|---|---|
| Molecular Weight | 381.17 g/mol |
| LogP | 3.6773 |
| Topological Polar Surface Area | 40.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 381.1707 |
| Heavy Atoms | 26 |
| Complexity | 510.0 |
Chemical Identifiers
| CAS Number | 75917-42-9 |
|---|---|
| SMILES | CCO[C@@H]1C2=CC(=C(C=C2[C@@H]3[C@H](O1)CC=C4[C@H]3N(CC4)C)OC)OC.Cl |
| InChIKey | JQXCWYYVEHLNPK-MQXQPWMHSA-N |
Product Overview
9-O-ethyl lycorenine (CAS 75917-42-9), with molecular formula C20H28ClNO4 and molecular weight 381.17 g/mol. IUPAC: (5aR,7S,11bS,11cS)-7-ethoxy-9,10-dimethoxy-1-methyl-3,5,5a,7,11b,11c-hexahydro-2H-isochromeno[3,4-g]indole;hydrochloride.
Chemical Property Profile of 9-O-ethyl lycorenine
Property Insights of 9-O-ethyl lycorenine
The XLogP value of 3.6773 indicates that 9-O-ethyl lycorenine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.2 Ų, 9-O-ethyl lycorenine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9-O-ethyl lycorenine has 1 hydrogen bond donor(s) and 5 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 9-O-ethyl lycorenine?
The CAS number of 9-O-ethyl lycorenine is 75917-42-9.
What is the molecular formula of 9-O-ethyl lycorenine?
The molecular formula of 9-O-ethyl lycorenine is C20H28ClNO4.
What is the molecular weight of 9-O-ethyl lycorenine?
The molecular weight of 9-O-ethyl lycorenine is 381.17 g/mol.
Where can I buy 9-O-ethyl lycorenine?
You can request a quote for 9-O-ethyl lycorenine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9-O-ethyl lycorenine?
Yes, KEHONG BIO provides custom synthesis services for 9-O-ethyl lycorenine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.