19-Ethoxy-3,19-epoxycarda-5,14,20(22)-trienolide
TL;DR: 19-Ethoxy-3,19-epoxycarda-5,14,20(22)-trienolide (CAS 87414-18-4) is a chemical compound with molecular formula C25H32O4 and molecular weight 396.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(17-ethoxy-5-methyl-16-oxapentacyclo[13.2.2.01,13.02,10.05,9]nonadeca-8,12-dien-6-yl)-2H-furan-5-one
Also Known As: 19-ethoxy-3,19-epoxycarda-5,14,20(22)-trienolide
| Molecular Formula | C25H32O4 |
|---|---|
| Molecular Weight | 396.23 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 44.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 396.23007 |
| Heavy Atoms | 29 |
| Complexity | 838.0 |
Chemical Identifiers
| CAS Number | 87414-18-4 |
|---|---|
| SMILES | CCOC1C23CCC(O1)CC2=CCC4C3CCC5(C4=CCC5C6=CC(=O)OC6)C |
| InChIKey | UCLLPTKRBIBVHQ-UHFFFAOYSA-N |
Product Overview
19-Ethoxy-3,19-epoxycarda-5,14,20(22)-trienolide (CAS 87414-18-4), with molecular formula C25H32O4 and molecular weight 396.23 g/mol. IUPAC: 3-(17-ethoxy-5-methyl-16-oxapentacyclo[13.2.2.01,13.02,10.05,9]nonadeca-8,12-dien-6-yl)-2H-furan-5-one.
Chemical Property Profile of 19-Ethoxy-3,19-epoxycarda-5,14,20(22)-trienolide
Property Insights of 19-Ethoxy-3,19-epoxycarda-5,14,20(22)-trienolide
The XLogP value of 3.4 indicates that 19-Ethoxy-3,19-epoxycarda-5,14,20(22)-trienolide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.8 Ų, 19-Ethoxy-3,19-epoxycarda-5,14,20(22)-trienolide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 19-Ethoxy-3,19-epoxycarda-5,14,20(22)-trienolide 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 19-Ethoxy-3,19-epoxycarda-5,14,20(22)-trienolide?
The CAS number of 19-Ethoxy-3,19-epoxycarda-5,14,20(22)-trienolide is 87414-18-4.
What is the molecular formula of 19-Ethoxy-3,19-epoxycarda-5,14,20(22)-trienolide?
The molecular formula of 19-Ethoxy-3,19-epoxycarda-5,14,20(22)-trienolide is C25H32O4.
What is the molecular weight of 19-Ethoxy-3,19-epoxycarda-5,14,20(22)-trienolide?
The molecular weight of 19-Ethoxy-3,19-epoxycarda-5,14,20(22)-trienolide is 396.23 g/mol.
Where can I buy 19-Ethoxy-3,19-epoxycarda-5,14,20(22)-trienolide?
You can request a quote for 19-Ethoxy-3,19-epoxycarda-5,14,20(22)-trienolide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 19-Ethoxy-3,19-epoxycarda-5,14,20(22)-trienolide?
Yes, KEHONG BIO provides custom synthesis services for 19-Ethoxy-3,19-epoxycarda-5,14,20(22)-trienolide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.