Enacyloxin iia
TL;DR: Enacyloxin iia (CAS 126518-41-0) is a chemical compound with molecular formula C33H45Cl2NO11 and molecular weight 701.23694 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(1S,3R,4S)-3-[(2E,4E,6E,8E,10Z,12S,13R,14S,17R,18S,19R,20E)-19-carbamoyloxy-11,18-dichloro-13,14,17-trihydroxy-6,12-dimethyl-15-oxotricosa-2,4,6,8,10,20-hexaenoyl]oxy-4-hydroxycyclohexane-1-carboxylic acid
Also Known As: Enacyloxin iia, (1S,3R,4S)-3-[(2E,4E,6E,8E,10Z,12S,13R,14S,17R,18S,19R,20E)-19-carbamoyloxy-11,18-dichloro-13,14,17-trihydroxy-6,12-dimethyl-15-oxotricosa-2,4,6,8,10,20-hexaenoyl]oxy-4-hydroxycyclohexane-1-carboxylic acid, ENX, (1S,3R,4S)-3-{[(2E,4E,6E,8E,10Z,12S,13R,14S,17R,18S,19R,20E)-19-(carbamoyloxy)-11,18-dichloro-13,14,17-trihydroxy-6,12-dimethyl-15-oxotricosa-2,4,6,8,10,20-hexaenoyl]oxy}-4-hydroxycyclohexanecarboxylic acid
Technical Specifications
| Molecular Formula | C33H45Cl2NO11 |
| Molecular Weight | 701.23694 g/mol |
| XLogP | 3.7 |
| Topological Polar Surface Area (TPSA) | 214.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 20 |
| Exact Mass | 701.23694 Da |
| Heavy Atoms | 47 |
| Complexity | 1240.0 |
| SMILES | CC/C=C/[C@H]([C@H]([C@@H](CC(=O)[C@H]([C@@H]([C@H](C)/C(=C/C=C/C=C(\C)/C=C/C=C/C(=O)O[C@@H]1C[C@H](CC[C@@H]1O)C(=O)O)/Cl)O)O)O)Cl)OC(=O)N |
| InChIKey | IWBADCVFZDCUTN-OCXJTLLTSA-N |
Chemical Property Profile of Enacyloxin iia
Property Insights of Enacyloxin iia
The XLogP value of 3.7 indicates that Enacyloxin iia is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 214.0 Ų indicates high polarity, suggesting Enacyloxin iia may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Enacyloxin iia has 6 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Enacyloxin iia?
The CAS number of Enacyloxin iia is 126518-41-0.
What is the molecular formula of Enacyloxin iia?
The molecular formula of Enacyloxin iia is C33H45Cl2NO11.
What is the molecular weight of Enacyloxin iia?
The molecular weight of Enacyloxin iia is 701.23694 g/mol.
Where can I buy Enacyloxin iia?
You can request a quote for Enacyloxin iia directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Enacyloxin iia?
Yes, CoreyChem provides custom synthesis services for Enacyloxin iia and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.