Epilimonol Chloroacetate
TL;DR: Epilimonol Chloroacetate (CAS 86900-10-9) is a chemical compound with molecular formula C28H33ClO9 and molecular weight 548.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(1R,2R,7S,10R,12S,13S,14R,16S,20S)-19-(furan-3-yl)-9,9,13,20-tetramethyl-5,17-dioxo-4,8,15,18-tetraoxahexacyclo[11.9.0.02,7.02,10.014,16.014,20]docosan-12-yl] 2-chloroacetate
Also Known As: Epilimonol chloroacetate, EPILIMONOL CHLORACETATE, (4aS,6aR,8S,8aS,8bR,9aS,12aS,14aR,14bR)-12-(Furan-3-yl)-6,6,8a,12a-tetramethyl-3,10-dioxotetradecahydro-1H,3H-oxireno[c]pyrano[4'',3'':2',3']furo[3',4':5,6]naphtho[1,2-d]pyran-8-yl chloroacetate, RefChem:137225
| Molecular Formula | C28H33ClO9 |
|---|---|
| Molecular Weight | 548.18 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 114.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 4 |
| Exact Mass | 548.18134 |
| Heavy Atoms | 38 |
| Complexity | 1090.0 |
Chemical Identifiers
| CAS Number | 86900-10-9 |
|---|---|
| SMILES | C[C@@]12CC[C@H]3[C@]([C@@]14[C@H](O4)C(=O)OC2C5=COC=C5)([C@H](C[C@@H]6[C@@]37COC(=O)C[C@@H]7OC6(C)C)OC(=O)CCl)C |
| InChIKey | GFBDUCGTXNWVSJ-OILWHDHASA-N |
Product Overview
Epilimonol Chloroacetate (CAS 86900-10-9), with molecular formula C28H33ClO9 and molecular weight 548.18 g/mol. IUPAC: [(1R,2R,7S,10R,12S,13S,14R,16S,20S)-19-(furan-3-yl)-9,9,13,20-tetramethyl-5,17-dioxo-4,8,15,18-tetraoxahexacyclo[11.9.0.02,7.02,10.014,16.014,20]docosan-12-yl] 2-chloroacetate.
Chemical Property Profile of Epilimonol Chloroacetate
Property Insights of Epilimonol Chloroacetate
The XLogP value of 3.3 indicates that Epilimonol Chloroacetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 114.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Epilimonol Chloroacetate. Following Lipinski's Rule of Five, Epilimonol Chloroacetate has 0 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Epilimonol Chloroacetate?
The CAS number of Epilimonol Chloroacetate is 86900-10-9.
What is the molecular formula of Epilimonol Chloroacetate?
The molecular formula of Epilimonol Chloroacetate is C28H33ClO9.
What is the molecular weight of Epilimonol Chloroacetate?
The molecular weight of Epilimonol Chloroacetate is 548.18 g/mol.
Where can I buy Epilimonol Chloroacetate?
You can request a quote for Epilimonol Chloroacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Epilimonol Chloroacetate?
Yes, KEHONG BIO provides custom synthesis services for Epilimonol Chloroacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.