Aceteylleptocarpin
TL;DR: Aceteylleptocarpin (CAS 73522-57-3) is a chemical compound with molecular formula C22H28O7 and molecular weight 404.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(1R,2R,4R,6R,9E,11R)-8-acetyloxy-4,9-dimethyl-14-methylidene-13-oxo-5,12-dioxatricyclo[9.3.0.04,6]tetradec-9-en-2-yl] (Z)-2-methylbut-2-enoate
Also Known As: Aceteylleptocarpin, Leptocarpin acetate, [(1R,2R,4R,6R,9E,11R)-8-acetyloxy-4,9-dimethyl-14-methylidene-13-oxo-5,12-dioxatricyclo[9.3.0.04,6]tetradec-9-en-2-yl] (Z)-2-methylbut-2-enoate, 2-Butenoic acid, 2-methyl-, (1aR,3S,4Z,5aR,8aR,9R,10aR)-3-(acetyloxy)-1a,2,3,5a,7,8,8a,9,10,10a-decahydro-4,10a-dimethyl-8-methylene-7-oxooxireno(5,6)cyclodeca(1,2-b)furan-9-yl ester, (2Z)-
| Molecular Formula | C22H28O7 |
|---|---|
| Molecular Weight | 404.18 g/mol |
| LogP | 2.7915 |
| Topological Polar Surface Area | 91.43 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 404.1835 |
| Heavy Atoms | 29 |
| Complexity | 807.9784 |
Chemical Identifiers
| CAS Number | 73522-57-3 |
|---|---|
| SMILES | C/C=C(/C)\C(=O)O[C@@H]1C[C@@]2([C@H](O2)CC(/C(=C/[C@@H]3[C@@H]1C(=C)C(=O)O3)/C)OC(=O)C)C |
Product Overview
Aceteylleptocarpin (CAS 73522-57-3), with molecular formula C22H28O7 and molecular weight 404.18 g/mol. IUPAC: [(1R,2R,4R,6R,9E,11R)-8-acetyloxy-4,9-dimethyl-14-methylidene-13-oxo-5,12-dioxatricyclo[9.3.0.04,6]tetradec-9-en-2-yl] (Z)-2-methylbut-2-enoate.
Chemical Property Profile of Aceteylleptocarpin
Property Insights of Aceteylleptocarpin
The XLogP value of 2.7915 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Aceteylleptocarpin. The TPSA of 91.43 Ų falls within the moderate polarity range, balancing permeability and solubility for Aceteylleptocarpin. Following Lipinski's Rule of Five, Aceteylleptocarpin has 0 hydrogen bond donor(s) and 7 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 Aceteylleptocarpin?
The CAS number of Aceteylleptocarpin is 73522-57-3.
What is the molecular formula of Aceteylleptocarpin?
The molecular formula of Aceteylleptocarpin is C22H28O7.
What is the molecular weight of Aceteylleptocarpin?
The molecular weight of Aceteylleptocarpin is 404.18 g/mol.
Where can I buy Aceteylleptocarpin?
You can request a quote for Aceteylleptocarpin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Aceteylleptocarpin?
Yes, KEHONG BIO provides custom synthesis services for Aceteylleptocarpin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.