Chapliatrin
TL;DR: Chapliatrin (CAS 57800-56-3) is a chemical compound with molecular formula C24H32O10 and molecular weight 480.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2S,6R,7R,9R,12R,13R)-13-(acetyloxymethyl)-12-hydroxy-9-methyl-5-methylidene-4-oxo-3,14-dioxatricyclo[7.4.1.02,6]tetradecan-7-yl] (Z)-2-(acetyloxymethyl)but-2-enoate
Also Known As: CHAPLIATRIN, (1R,2S,6S,7R,9S,12S,13S)-13-((Acetyloxy)methyl)-12-hydroxy-9-methyl-5-methylidene-4-oxo-3,14-dioxatricyclo(7.4.1.0,)tetradecan-7-yl (2E)-2-((acetyloxy)methyl)but-2-enoic acid, (1R,2S,6S,7R,9S,12S,13S)-13-[(Acetyloxy)methyl]-12-hydroxy-9-methyl-5-methylidene-4-oxo-3,14-dioxatricyclo[7.4.1.0,]tetradecan-7-yl (2E)-2-[(acetyloxy)methyl]but-2-enoic acid, (3aR,4R,6R,9R,10R,11aS)-10-[(Acetyloxy)methyl]-9-hydroxy-6-methyl-3-methylidene-2-oxododecahydro-6,11-epoxycyclodeca[b]furan-4-yl (2Z)-2-[(acetyloxy)methyl]but-2-enoate, [(2S,6R,7R,9R,12R,13R)-13-(acetyloxymethyl)-12-hydroxy-9-methyl-5-methylidene-4-oxo-3,14-dioxatricyclo[7.4.1.02,6]tetradecan-7-yl] (Z)-2-(acetyloxymethyl)but-2-enoate
| Molecular Formula | C24H32O10 |
|---|---|
| Molecular Weight | 480.20 g/mol |
| LogP | 1.387 |
| Topological Polar Surface Area | 134.66 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 6 |
| Exact Mass | 480.19955 |
| Heavy Atoms | 34 |
| Complexity | 892.1846 |
Chemical Identifiers
| CAS Number | 57800-56-3 |
|---|---|
| SMILES | C/C=C(/COC(=O)C)\C(=O)O[C@@H]1C[C@]2(CC[C@H]([C@H](C(O2)[C@@H]3[C@@H]1C(=C)C(=O)O3)COC(=O)C)O)C |
Product Overview
Chapliatrin (CAS 57800-56-3), with molecular formula C24H32O10 and molecular weight 480.20 g/mol. IUPAC: [(2S,6R,7R,9R,12R,13R)-13-(acetyloxymethyl)-12-hydroxy-9-methyl-5-methylidene-4-oxo-3,14-dioxatricyclo[7.4.1.02,6]tetradecan-7-yl] (Z)-2-(acetyloxymethyl)but-2-enoate.
Chemical Property Profile of Chapliatrin
Property Insights of Chapliatrin
The XLogP value of 1.387 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Chapliatrin. The TPSA of 134.66 Ų falls within the moderate polarity range, balancing permeability and solubility for Chapliatrin. Following Lipinski's Rule of Five, Chapliatrin has 1 hydrogen bond donor(s) and 10 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 Chapliatrin?
The CAS number of Chapliatrin is 57800-56-3.
What is the molecular formula of Chapliatrin?
The molecular formula of Chapliatrin is C24H32O10.
What is the molecular weight of Chapliatrin?
The molecular weight of Chapliatrin is 480.20 g/mol.
Where can I buy Chapliatrin?
You can request a quote for Chapliatrin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Chapliatrin?
Yes, KEHONG BIO provides custom synthesis services for Chapliatrin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.