11-epi-Sinulariolide
TL;DR: 11-epi-Sinulariolide (CAS 88643-48-5) is a chemical compound with molecular formula C20H30O4 and molecular weight 334.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1R,3S,5S,8E,12R,13R)-12-hydroxy-5,9,13-trimethyl-16-methylidene-4,14-dioxatricyclo[11.3.2.03,5]octadec-8-en-15-one
Also Known As: Sinulariolide, 11-epi-Sinulariolide, (1R,3S,5S,8E,12R,13R)-12-Hydroxy-5,9,13-trimethyl-16-methylidene-4,14-dioxatricyclo[11.3.2.03,5]octadec-8-en-15-one, 4,14-Dioxatricyclo(11.3.2.O(3.5))octadec-8-en-15-one, 12-hydroxy-5,9,13-trimethyl-16-methylene-, (1R-(1R*,3S*,5S*,8E,12R*,13R*))-
| Molecular Formula | C20H30O4 |
|---|---|
| Molecular Weight | 334.21 g/mol |
| LogP | 3.6833 |
| Topological Polar Surface Area | 59.06 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 334.21442 |
| Heavy Atoms | 24 |
| Complexity | 565.98615 |
Chemical Identifiers
| CAS Number | 88643-48-5 |
|---|---|
| SMILES | C/C/1=C\CC[C@]2([C@@H](O2)C[C@H]3CC[C@]([C@@H](CC1)O)(OC(=O)C3=C)C)C |
Product Overview
11-epi-Sinulariolide (CAS 88643-48-5), with molecular formula C20H30O4 and molecular weight 334.21 g/mol. IUPAC: (1R,3S,5S,8E,12R,13R)-12-hydroxy-5,9,13-trimethyl-16-methylidene-4,14-dioxatricyclo[11.3.2.03,5]octadec-8-en-15-one.
Chemical Property Profile of 11-epi-Sinulariolide
Property Insights of 11-epi-Sinulariolide
The XLogP value of 3.6833 indicates that 11-epi-Sinulariolide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.06 Ų, 11-epi-Sinulariolide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 11-epi-Sinulariolide has 1 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 11-epi-Sinulariolide?
The CAS number of 11-epi-Sinulariolide is 88643-48-5.
What is the molecular formula of 11-epi-Sinulariolide?
The molecular formula of 11-epi-Sinulariolide is C20H30O4.
What is the molecular weight of 11-epi-Sinulariolide?
The molecular weight of 11-epi-Sinulariolide is 334.21 g/mol.
Where can I buy 11-epi-Sinulariolide?
You can request a quote for 11-epi-Sinulariolide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 11-epi-Sinulariolide?
Yes, KEHONG BIO provides custom synthesis services for 11-epi-Sinulariolide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.