3,14-Dihydroxycarda-5,20(22)-dienolide
TL;DR: 3,14-Dihydroxycarda-5,20(22)-dienolide (CAS 508-92-9) is a chemical compound with molecular formula C23H32O4 and molecular weight 372.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(3S,10R,13R,14S)-3,14-dihydroxy-10,13-dimethyl-1,2,3,4,7,8,9,11,12,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]-2H-furan-5-one
Also Known As: Xysmalogenin, 5-Dehydrouzarigenin, 3,14-Dihydroxycarda-5,20(22)-dienolide, (3-beta)-3,14-Dihydroxycarda-5,20(22)-dienolide, Carda-5,20(22)-dienolide, 3,14-dihydroxy-, (3-beta)-
| Molecular Formula | C23H32O4 |
|---|---|
| Molecular Weight | 372.23 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 66.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 372.23007 |
| Heavy Atoms | 27 |
| Complexity | 739.0 |
Chemical Identifiers
| CAS Number | 508-92-9 |
|---|---|
| SMILES | C[C@]12CC[C@@H](CC1=CCC3C2CC[C@]4([C@@]3(CCC4C5=CC(=O)OC5)O)C)O |
| InChIKey | ZICGJBPBLVXOBM-GPCBFVFRSA-N |
Product Overview
3,14-Dihydroxycarda-5,20(22)-dienolide (CAS 508-92-9), with molecular formula C23H32O4 and molecular weight 372.23 g/mol. IUPAC: 3-[(3S,10R,13R,14S)-3,14-dihydroxy-10,13-dimethyl-1,2,3,4,7,8,9,11,12,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]-2H-furan-5-one.
Chemical Property Profile of 3,14-Dihydroxycarda-5,20(22)-dienolide
Property Insights of 3,14-Dihydroxycarda-5,20(22)-dienolide
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,14-Dihydroxycarda-5,20(22)-dienolide. The TPSA of 66.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,14-Dihydroxycarda-5,20(22)-dienolide. Following Lipinski's Rule of Five, 3,14-Dihydroxycarda-5,20(22)-dienolide has 2 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 3,14-Dihydroxycarda-5,20(22)-dienolide?
The CAS number of 3,14-Dihydroxycarda-5,20(22)-dienolide is 508-92-9.
What is the molecular formula of 3,14-Dihydroxycarda-5,20(22)-dienolide?
The molecular formula of 3,14-Dihydroxycarda-5,20(22)-dienolide is C23H32O4.
What is the molecular weight of 3,14-Dihydroxycarda-5,20(22)-dienolide?
The molecular weight of 3,14-Dihydroxycarda-5,20(22)-dienolide is 372.23 g/mol.
Where can I buy 3,14-Dihydroxycarda-5,20(22)-dienolide?
You can request a quote for 3,14-Dihydroxycarda-5,20(22)-dienolide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,14-Dihydroxycarda-5,20(22)-dienolide?
Yes, KEHONG BIO provides custom synthesis services for 3,14-Dihydroxycarda-5,20(22)-dienolide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.