Scillarenin
TL;DR: Scillarenin (CAS 4968-81-4) is a chemical compound with molecular formula C24H32O4 and molecular weight 384.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(3S,10R,13R,14S,17R)-3,14-dihydroxy-10,13-dimethyl-1,2,3,6,7,8,9,11,12,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]pyran-2-one
Also Known As: Scillarenin, Cardiogenin, Scillarenine, Scillarenin A, beta-Scillarenin
| Molecular Formula | C24H32O4 |
|---|---|
| Molecular Weight | 384.23 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 66.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 384.23007 |
| Heavy Atoms | 28 |
| Complexity | 794.0 |
Chemical Identifiers
| CAS Number | 4968-81-4 |
|---|---|
| SMILES | C[C@]12CCC3C([C@]1(CC[C@@H]2C4=COC(=O)C=C4)O)CCC5=C[C@H](CC[C@]35C)O |
| InChIKey | OVUOVMIMOCJILI-XFPCGWMYSA-N |
Product Overview
Scillarenin (CAS 4968-81-4), with molecular formula C24H32O4 and molecular weight 384.23 g/mol. IUPAC: 5-[(3S,10R,13R,14S,17R)-3,14-dihydroxy-10,13-dimethyl-1,2,3,6,7,8,9,11,12,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]pyran-2-one.
Chemical Property Profile of Scillarenin
Property Insights of Scillarenin
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Scillarenin. The TPSA of 66.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Scillarenin. Following Lipinski's Rule of Five, Scillarenin 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 Scillarenin?
The CAS number of Scillarenin is 4968-81-4.
What is the molecular formula of Scillarenin?
The molecular formula of Scillarenin is C24H32O4.
What is the molecular weight of Scillarenin?
The molecular weight of Scillarenin is 384.23 g/mol.
Where can I buy Scillarenin?
You can request a quote for Scillarenin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Scillarenin?
Yes, KEHONG BIO provides custom synthesis services for Scillarenin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.