Erythraline
TL;DR: Erythraline (CAS 466-77-3) is a chemical compound with molecular formula C18H19NO3 and molecular weight 297.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S,19R)-19-methoxy-5,7-dioxa-13-azapentacyclo[11.7.0.01,16.02,10.04,8]icosa-2,4(8),9,15,17-pentaene
Also Known As: Erythraline, Erythralin, (+)-Erythraline, eritralin, methoxy[?]
| Molecular Formula | C18H19NO3 |
|---|---|
| Molecular Weight | 297.14 g/mol |
| LogP | 2.3836 |
| Topological Polar Surface Area | 30.93 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 297.1365 |
| Heavy Atoms | 22 |
| Complexity | 708.529 |
Chemical Identifiers
| CAS Number | 466-77-3 |
|---|---|
| SMILES | CO[C@@H]1C[C@@]23C(=CCN2CCC4=CC5=C(C=C34)OCO5)C=C1 |
Product Overview
Erythraline (CAS 466-77-3), with molecular formula C18H19NO3 and molecular weight 297.14 g/mol. IUPAC: (1S,19R)-19-methoxy-5,7-dioxa-13-azapentacyclo[11.7.0.01,16.02,10.04,8]icosa-2,4(8),9,15,17-pentaene.
Chemical Property Profile of Erythraline
Property Insights of Erythraline
The XLogP value of 2.3836 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Erythraline. With a topological polar surface area (TPSA) of 30.93 Ų, Erythraline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Erythraline 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 Erythraline?
The CAS number of Erythraline is 466-77-3.
What is the molecular formula of Erythraline?
The molecular formula of Erythraline is C18H19NO3.
What is the molecular weight of Erythraline?
The molecular weight of Erythraline is 297.14 g/mol.
Where can I buy Erythraline?
You can request a quote for Erythraline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Erythraline?
Yes, KEHONG BIO provides custom synthesis services for Erythraline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.