Corotoxigenin
TL;DR: Corotoxigenin (CAS 49810-25-5) is a chemical compound with molecular formula C23H32O5 and molecular weight 388.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3S,5S,10R,13R,14S,17R)-3,14-dihydroxy-13-methyl-17-(5-oxo-2H-furan-3-yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthrene-10-carbaldehyde
Also Known As: Corotoxigenin, KST-1A5073, (3, A,5, A,8xi,9xi)-3,14-dihydroxy-19-oxocard-20(22)-enolide
| Molecular Formula | C23H32O5 |
|---|---|
| Molecular Weight | 388.22 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 83.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 388.22498 |
| Heavy Atoms | 28 |
| Complexity | 731.0 |
Chemical Identifiers
| CAS Number | 49810-25-5 |
|---|---|
| SMILES | C[C@]12CCC3C([C@]1(CC[C@@H]2C4=CC(=O)OC4)O)CC[C@@H]5[C@@]3(CC[C@@H](C5)O)C=O |
| InChIKey | JNTNUSUPTSNMNJ-FORWYNSGSA-N |
Product Overview
Corotoxigenin (CAS 49810-25-5), with molecular formula C23H32O5 and molecular weight 388.22 g/mol. IUPAC: (3S,5S,10R,13R,14S,17R)-3,14-dihydroxy-13-methyl-17-(5-oxo-2H-furan-3-yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthrene-10-carbaldehyde.
Chemical Property Profile of Corotoxigenin
Property Insights of Corotoxigenin
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Corotoxigenin. The TPSA of 83.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Corotoxigenin. Following Lipinski's Rule of Five, Corotoxigenin has 2 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 Corotoxigenin?
The CAS number of Corotoxigenin is 49810-25-5.
What is the molecular formula of Corotoxigenin?
The molecular formula of Corotoxigenin is C23H32O5.
What is the molecular weight of Corotoxigenin?
The molecular weight of Corotoxigenin is 388.22 g/mol.
Where can I buy Corotoxigenin?
You can request a quote for Corotoxigenin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Corotoxigenin?
Yes, KEHONG BIO provides custom synthesis services for Corotoxigenin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.