8-Ketoverrucarin A
TL;DR: 8-Ketoverrucarin A (CAS 74516-63-5) is a chemical compound with molecular formula C27H32O10 and molecular weight 516.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(18Z,20Z)-12-hydroxy-5,13,25-trimethylspiro[2,10,16,23-tetraoxatetracyclo[22.2.1.03,8.08,25]heptacosa-4,18,20-triene-26,2'-oxirane]-6,11,17,22-tetrone
Also Known As: 8-Ketoverrucarin A, 8-Oxoverrucarin A, VERRUCARIN A MONO KETONE, (18Z,20Z)-12-Hydroxy-5,13,25-trimethylspiro[2,10,16,23-tetraoxatetracyclo[22.2.1.03,8.08,25]heptacosa-4,18,20-triene-26,2'-oxirane]-6,11,17,22-tetrone
| Molecular Formula | C27H32O10 |
|---|---|
| Molecular Weight | 516.20 g/mol |
| LogP | 1.3496 |
| Topological Polar Surface Area | 137.96 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 0 |
| Exact Mass | 516.1995 |
| Heavy Atoms | 37 |
| Complexity | 1100.4661 |
Chemical Identifiers
| CAS Number | 74516-63-5 |
|---|---|
| SMILES | CC1CCOC(=O)/C=C\C=C/C(=O)OC2CC3C4(C2(C5(CC(=O)C(=CC5O3)C)COC(=O)C1O)C)CO4 |
Product Overview
8-Ketoverrucarin A (CAS 74516-63-5), with molecular formula C27H32O10 and molecular weight 516.20 g/mol. IUPAC: (18Z,20Z)-12-hydroxy-5,13,25-trimethylspiro[2,10,16,23-tetraoxatetracyclo[22.2.1.03,8.08,25]heptacosa-4,18,20-triene-26,2'-oxirane]-6,11,17,22-tetrone.
Chemical Property Profile of 8-Ketoverrucarin A
Property Insights of 8-Ketoverrucarin A
The XLogP value of 1.3496 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-Ketoverrucarin A. The TPSA of 137.96 Ų falls within the moderate polarity range, balancing permeability and solubility for 8-Ketoverrucarin A. Following Lipinski's Rule of Five, 8-Ketoverrucarin A has 1 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 8-Ketoverrucarin A?
The CAS number of 8-Ketoverrucarin A is 74516-63-5.
What is the molecular formula of 8-Ketoverrucarin A?
The molecular formula of 8-Ketoverrucarin A is C27H32O10.
What is the molecular weight of 8-Ketoverrucarin A?
The molecular weight of 8-Ketoverrucarin A is 516.20 g/mol.
Where can I buy 8-Ketoverrucarin A?
You can request a quote for 8-Ketoverrucarin A directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-Ketoverrucarin A?
Yes, KEHONG BIO provides custom synthesis services for 8-Ketoverrucarin A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.