EUPACHLOROXIN
TL;DR: EUPACHLOROXIN (CAS 20071-52-7) is a chemical compound with molecular formula C20H25ClO8 and molecular weight 428.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[9-(chloromethyl)-1,9,11-trihydroxy-14-methyl-5-methylidene-4-oxo-3,13-dioxatetracyclo[8.4.0.02,6.012,14]tetradecan-7-yl] 2-methylbut-2-enoate
Also Known As: EUPACHLOROXIN, NCI60_000331, 2-Butenoic acid, 2-methyl-, (3aR,4R,6R,6aR,7S,7aR,8aR,8bR,8cS)-6-(chloromethyl)dodecahydro-6,7,8b-trihydroxy-8a-methyl-3-methylene-2-oxooxireno[2,3]azuleno[4,5-b]furan-4-yl ester, (2Z)-
| Molecular Formula | C20H25ClO8 |
|---|---|
| Molecular Weight | 428.12 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 126.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 428.1238 |
| Heavy Atoms | 29 |
| Complexity | 825.0 |
Chemical Identifiers
| CAS Number | 20071-52-7 |
|---|---|
| SMILES | CC=C(C)C(=O)OC1CC(C2C(C3C(C2(C4C1C(=C)C(=O)O4)O)(O3)C)O)(CCl)O |
| InChIKey | ZKXZLEVGQXDZEP-UHFFFAOYSA-N |
Product Overview
EUPACHLOROXIN (CAS 20071-52-7), with molecular formula C20H25ClO8 and molecular weight 428.12 g/mol. IUPAC: [9-(chloromethyl)-1,9,11-trihydroxy-14-methyl-5-methylidene-4-oxo-3,13-dioxatetracyclo[8.4.0.02,6.012,14]tetradecan-7-yl] 2-methylbut-2-enoate.
Chemical Property Profile of EUPACHLOROXIN
Property Insights of EUPACHLOROXIN
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for EUPACHLOROXIN. The TPSA of 126.0 Ų falls within the moderate polarity range, balancing permeability and solubility for EUPACHLOROXIN. Following Lipinski's Rule of Five, EUPACHLOROXIN has 3 hydrogen bond donor(s) and 8 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 EUPACHLOROXIN?
The CAS number of EUPACHLOROXIN is 20071-52-7.
What is the molecular formula of EUPACHLOROXIN?
The molecular formula of EUPACHLOROXIN is C20H25ClO8.
What is the molecular weight of EUPACHLOROXIN?
The molecular weight of EUPACHLOROXIN is 428.12 g/mol.
Where can I buy EUPACHLOROXIN?
You can request a quote for EUPACHLOROXIN directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for EUPACHLOROXIN?
Yes, KEHONG BIO provides custom synthesis services for EUPACHLOROXIN and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.