7-Ketolyoniol B
TL;DR: 7-Ketolyoniol B (CAS 40031-16-1) is a chemical compound with molecular formula C20H30O6 and molecular weight 366.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4,10,15-tetrahydroxy-5,5,10,15-tetramethyl-7-oxapentacyclo[12.2.1.01,11.04,9.06,8]heptadecan-2-one
Also Known As: 7-Ketolyoniol B, 5,6,10,16-tetrahydroxy-2,3-epoxygrayanotoxan-7-one, 5,7a-Methano-7aH-cyclohept(6,7)azuleno(1,2-b)oxiren-8(1aH)-one, dodecahydro-2,6,9,9a-tetrahydroxy-2,6,10,10-tetramethyl-, (1aS-(1a-alpha,1b-alpha,2-alpha,2a-beta,5-alpha,6-alpha,7a-alpha,9-beta,9a-beta,10a-alpha))-
| Molecular Formula | C20H30O6 |
|---|---|
| Molecular Weight | 366.20 g/mol |
| LogP | -0.2 |
| Topological Polar Surface Area | 111.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 366.20422 |
| Heavy Atoms | 26 |
| Complexity | 706.0 |
Chemical Identifiers
| CAS Number | 40031-16-1 |
|---|---|
| SMILES | CC1(C2C(O2)C3C1(C(C(=O)C45CC(CCC4C3(C)O)C(C5)(C)O)O)O)C |
| InChIKey | AMKGWZFHNATSPK-UHFFFAOYSA-N |
Product Overview
7-Ketolyoniol B (CAS 40031-16-1), with molecular formula C20H30O6 and molecular weight 366.20 g/mol. IUPAC: 3,4,10,15-tetrahydroxy-5,5,10,15-tetramethyl-7-oxapentacyclo[12.2.1.01,11.04,9.06,8]heptadecan-2-one.
Chemical Property Profile of 7-Ketolyoniol B
Property Insights of 7-Ketolyoniol B
The XLogP value of -0.2 indicates that 7-Ketolyoniol B is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 111.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-Ketolyoniol B. Following Lipinski's Rule of Five, 7-Ketolyoniol B has 4 hydrogen bond donor(s) and 6 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 7-Ketolyoniol B?
The CAS number of 7-Ketolyoniol B is 40031-16-1.
What is the molecular formula of 7-Ketolyoniol B?
The molecular formula of 7-Ketolyoniol B is C20H30O6.
What is the molecular weight of 7-Ketolyoniol B?
The molecular weight of 7-Ketolyoniol B is 366.20 g/mol.
Where can I buy 7-Ketolyoniol B?
You can request a quote for 7-Ketolyoniol B directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-Ketolyoniol B?
Yes, KEHONG BIO provides custom synthesis services for 7-Ketolyoniol B and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.