Cystoketal
TL;DR: Cystoketal (CAS 96253-60-0) is a chemical compound with molecular formula C28H38O4 and molecular weight 438.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(E)-4-[(4aS,7aS)-4a,5',5',7a-tetramethylspiro[6,7-dihydro-5H-cyclopenta[c]pyran-1,2'-furan]-3-yl]-3-methylbut-2-enyl]-4-methoxy-6-methylphenol
Also Known As: Cystoketal, Cystoketal from Cystoseira balearica, 2-[(E)-4-[(4aS,7aS)-4a,5',5',7a-tetramethylspiro[6,7-dihydro-5H-cyclopenta[c]pyran-1,2'-furan]-3-yl]-3-methylbut-2-enyl]-4-methoxy-6-methylphenol
| Molecular Formula | C28H38O4 |
|---|---|
| Molecular Weight | 438.28 g/mol |
| LogP | 6.76002 |
| Topological Polar Surface Area | 47.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 438.277 |
| Heavy Atoms | 32 |
| Complexity | 1000.92993 |
Chemical Identifiers
| CAS Number | 96253-60-0 |
|---|---|
| SMILES | CC1=CC(=CC(=C1O)C/C=C(\C)/CC2=C[C@@]3(CCC[C@@]3(C4(O2)C=CC(O4)(C)C)C)C)OC |
Product Overview
Cystoketal (CAS 96253-60-0), with molecular formula C28H38O4 and molecular weight 438.28 g/mol. IUPAC: 2-[(E)-4-[(4aS,7aS)-4a,5',5',7a-tetramethylspiro[6,7-dihydro-5H-cyclopenta[c]pyran-1,2'-furan]-3-yl]-3-methylbut-2-enyl]-4-methoxy-6-methylphenol.
Chemical Property Profile of Cystoketal
Property Insights of Cystoketal
The XLogP value of 6.76002 indicates that Cystoketal is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.92 Ų, Cystoketal exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cystoketal has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Cystoketal?
The CAS number of Cystoketal is 96253-60-0.
What is the molecular formula of Cystoketal?
The molecular formula of Cystoketal is C28H38O4.
What is the molecular weight of Cystoketal?
The molecular weight of Cystoketal is 438.28 g/mol.
Where can I buy Cystoketal?
You can request a quote for Cystoketal directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cystoketal?
Yes, KEHONG BIO provides custom synthesis services for Cystoketal and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.