3,14,19-Trihydroxycard-20(22)-enolide
TL;DR: 3,14,19-Trihydroxycard-20(22)-enolide (CAS 4764-79-8) is a chemical compound with molecular formula C23H34O5 and molecular weight 390.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[3,14-dihydroxy-10-(hydroxymethyl)-13-methyl-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]-2H-furan-5-one
Also Known As: Coroglaucigenin, 3,14,19-trihydroxycard-20(22)-enolide, 5.alpha.-Card-20(22)-enolide,14,19-trihydroxy-, 3-beta,14,19-Trihydroxy-5-alpha-card-20(22)-enolide, Card-20(22)-enolide,14,19-trihydroxy-, (3.beta.,5.alpha.)-
| Molecular Formula | C23H34O5 |
|---|---|
| Molecular Weight | 390.24 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 87.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 390.24063 |
| Heavy Atoms | 28 |
| Complexity | 703.0 |
Chemical Identifiers
| CAS Number | 4764-79-8 |
|---|---|
| SMILES | CC12CCC3C(C1(CCC2C4=CC(=O)OC4)O)CCC5C3(CCC(C5)O)CO |
| InChIKey | CDMVQQAHEQVSMF-UHFFFAOYSA-N |
Product Overview
3,14,19-Trihydroxycard-20(22)-enolide (CAS 4764-79-8), with molecular formula C23H34O5 and molecular weight 390.24 g/mol. IUPAC: 3-[3,14-dihydroxy-10-(hydroxymethyl)-13-methyl-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]-2H-furan-5-one.
Chemical Property Profile of 3,14,19-Trihydroxycard-20(22)-enolide
Property Insights of 3,14,19-Trihydroxycard-20(22)-enolide
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,14,19-Trihydroxycard-20(22)-enolide. The TPSA of 87.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,14,19-Trihydroxycard-20(22)-enolide. Following Lipinski's Rule of Five, 3,14,19-Trihydroxycard-20(22)-enolide has 3 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 3,14,19-Trihydroxycard-20(22)-enolide?
The CAS number of 3,14,19-Trihydroxycard-20(22)-enolide is 4764-79-8.
What is the molecular formula of 3,14,19-Trihydroxycard-20(22)-enolide?
The molecular formula of 3,14,19-Trihydroxycard-20(22)-enolide is C23H34O5.
What is the molecular weight of 3,14,19-Trihydroxycard-20(22)-enolide?
The molecular weight of 3,14,19-Trihydroxycard-20(22)-enolide is 390.24 g/mol.
Where can I buy 3,14,19-Trihydroxycard-20(22)-enolide?
You can request a quote for 3,14,19-Trihydroxycard-20(22)-enolide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,14,19-Trihydroxycard-20(22)-enolide?
Yes, KEHONG BIO provides custom synthesis services for 3,14,19-Trihydroxycard-20(22)-enolide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.