Ivasperine
TL;DR: Ivasperine (CAS 5956-43-4) is a chemical compound with molecular formula C15H20O4 and molecular weight 264.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(8S)-7,8-dihydroxy-8a-methyl-3,4-dimethylidene-3a,4a,5,6,7,8,9,9a-octahydrobenzo[f][1]benzofuran-2-one
Also Known As: Ivasperine, Ivasperin, (8S)-7,8-dihydroxy-8a-methyl-3,4-dimethylidene-3a,4a,5,6,7,8,9,9a-octahydrobenzo[f][1]benzofuran-2-one, Naphtho(2,3-b)furan-2(3H)-one, 3a-alpha,4,4a-alpha,5,6,7,8,8a,9a-alpha-decahydro-7-alpha,8-beta-dihydroxy-8a-beta-methyl-3,5-dimethylene-, (8S)-7,8-Dihydroxy-8a-methyl-3,4-dimethylidenedecahydronaphtho[2,3-b]furan-2(3H)-one
| Molecular Formula | C15H20O4 |
|---|---|
| Molecular Weight | 264.14 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 66.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 264.13617 |
| Heavy Atoms | 19 |
| Complexity | 469.0 |
Chemical Identifiers
| CAS Number | 5956-43-4 |
|---|---|
| SMILES | CC12CC3C(C(=C)C1CCC([C@H]2O)O)C(=C)C(=O)O3 |
| InChIKey | IWAWLFYVPNEIRS-CNOYCBBQSA-N |
Product Overview
Ivasperine (CAS 5956-43-4), with molecular formula C15H20O4 and molecular weight 264.14 g/mol. IUPAC: (8S)-7,8-dihydroxy-8a-methyl-3,4-dimethylidene-3a,4a,5,6,7,8,9,9a-octahydrobenzo[f][1]benzofuran-2-one.
Chemical Property Profile of Ivasperine
Property Insights of Ivasperine
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ivasperine. The TPSA of 66.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Ivasperine. Following Lipinski's Rule of Five, Ivasperine 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 Ivasperine?
The CAS number of Ivasperine is 5956-43-4.
What is the molecular formula of Ivasperine?
The molecular formula of Ivasperine is C15H20O4.
What is the molecular weight of Ivasperine?
The molecular weight of Ivasperine is 264.14 g/mol.
Where can I buy Ivasperine?
You can request a quote for Ivasperine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ivasperine?
Yes, KEHONG BIO provides custom synthesis services for Ivasperine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.