11-Methoxy-17-epi-alpha-yohimbine
TL;DR: 11-Methoxy-17-epi-alpha-yohimbine (CAS 84710-89-4) is a chemical compound with molecular formula C22H28N2O4 and molecular weight 384.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (1S,15S,18R,19S,20S)-18-hydroxy-6-methoxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylate
Also Known As: 11-Methoxyrauwolscine, 11-Methoxy-17-epi-alpha-yohimbine, Yohimban-16-carboxylic acid, 17-hydroxy-11-methoxy-, methyl ester, (16beta,17beta,20alpha)-, methyl 18-hydroxy-6-methoxy-1,3,11,12,14,15,16,17,18,19,20,2, Methyl (1S,15S,18R,19S,20R)-18-hydroxy-6-methoxy-3,13-diazapentacyclo(11.8.0.0,.0,.0,)henicosa-2(10),4(9),5,7-tetraene-19-carboxylic acid
| Molecular Formula | C22H28N2O4 |
|---|---|
| Molecular Weight | 384.20 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 74.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 384.2049 |
| Heavy Atoms | 28 |
| Complexity | 601.0 |
Chemical Identifiers
| CAS Number | 84710-89-4 |
|---|---|
| SMILES | COC1=CC2=C(C=C1)C3=C(N2)[C@@H]4C[C@H]5[C@H](CC[C@H]([C@H]5C(=O)OC)O)CN4CC3 |
| InChIKey | DBCVUIBEXPYXAJ-AKMABLNSSA-N |
Product Overview
11-Methoxy-17-epi-alpha-yohimbine (CAS 84710-89-4), with molecular formula C22H28N2O4 and molecular weight 384.20 g/mol. IUPAC: methyl (1S,15S,18R,19S,20S)-18-hydroxy-6-methoxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylate.
Chemical Property Profile of 11-Methoxy-17-epi-alpha-yohimbine
Property Insights of 11-Methoxy-17-epi-alpha-yohimbine
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 11-Methoxy-17-epi-alpha-yohimbine. The TPSA of 74.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 11-Methoxy-17-epi-alpha-yohimbine. Following Lipinski's Rule of Five, 11-Methoxy-17-epi-alpha-yohimbine has 2 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 11-Methoxy-17-epi-alpha-yohimbine?
The CAS number of 11-Methoxy-17-epi-alpha-yohimbine is 84710-89-4.
What is the molecular formula of 11-Methoxy-17-epi-alpha-yohimbine?
The molecular formula of 11-Methoxy-17-epi-alpha-yohimbine is C22H28N2O4.
What is the molecular weight of 11-Methoxy-17-epi-alpha-yohimbine?
The molecular weight of 11-Methoxy-17-epi-alpha-yohimbine is 384.20 g/mol.
Where can I buy 11-Methoxy-17-epi-alpha-yohimbine?
You can request a quote for 11-Methoxy-17-epi-alpha-yohimbine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 11-Methoxy-17-epi-alpha-yohimbine?
Yes, KEHONG BIO provides custom synthesis services for 11-Methoxy-17-epi-alpha-yohimbine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.