Ervatamine
TL;DR: Ervatamine (CAS 38091-01-9) 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.
methyl (3R,7S,8S)-7-ethyl-5-methyl-10-oxo-5,12-diazatetracyclo[9.7.0.03,8.013,18]octadeca-1(11),13,15,17-tetraene-3-carboxylate
Also Known As: Ervatamine, Epiervatamine, ervatarnine, Ervatamin, Ervatamine alkaloid
| Molecular Formula | C21H26N2O3 |
|---|---|
| Molecular Weight | 354.19 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 62.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 354.19434 |
| Heavy Atoms | 26 |
| Complexity | 580.0 |
Chemical Identifiers
| CAS Number | 38091-01-9 |
|---|---|
| SMILES | CC[C@@H]1CN(C[C@@]2([C@H]1CC(=O)C3=C(C2)C4=CC=CC=C4N3)C(=O)OC)C |
| InChIKey | METLQVFFFUYXNT-QTPGKHNVSA-N |
Product Overview
Ervatamine (CAS 38091-01-9), with molecular formula C21H26N2O3 and molecular weight 354.19 g/mol. IUPAC: methyl (3R,7S,8S)-7-ethyl-5-methyl-10-oxo-5,12-diazatetracyclo[9.7.0.03,8.013,18]octadeca-1(11),13,15,17-tetraene-3-carboxylate.
Chemical Property Profile of Ervatamine
Property Insights of Ervatamine
The XLogP value of 3.0 indicates that Ervatamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Ervatamine. Following Lipinski's Rule of Five, Ervatamine has 1 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 Ervatamine?
The CAS number of Ervatamine is 38091-01-9.
What is the molecular formula of Ervatamine?
The molecular formula of Ervatamine is C21H26N2O3.
What is the molecular weight of Ervatamine?
The molecular weight of Ervatamine is 354.19 g/mol.
Where can I buy Ervatamine?
You can request a quote for Ervatamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ervatamine?
Yes, KEHONG BIO provides custom synthesis services for Ervatamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.