EUPATOCUNOXIN
TL;DR: EUPATOCUNOXIN (CAS 39204-36-9) is a chemical compound with molecular formula C22H28O8 and molecular weight 420.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(9-acetyloxy-4-hydroxy-6,10-dimethyl-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-5-yl) 2,3-dimethyloxirane-2-carboxylate
Also Known As: EUPATOCUNOXIN, NCI60_000783, (9-acetyloxy-4-hydroxy-6,10-dimethyl-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-5-yl) 2,3-dimethyloxirane-2-carboxylate, 9-(acetyloxy)-4-hydroxy-6,10-dimethyl-3-methylidene-2-oxo-2,3,3a,4,5,8,9,11a-octahydrocyclodeca[b]furan-5-yl 2,3-dimethyloxirane-2-carboxylate
| Molecular Formula | C22H28O8 |
|---|---|
| Molecular Weight | 420.18 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 112.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 420.1784 |
| Heavy Atoms | 30 |
| Complexity | 840.0 |
Chemical Identifiers
| CAS Number | 39204-36-9 |
|---|---|
| SMILES | CC1C(O1)(C)C(=O)OC2C(C3C(C=C(C(CC=C2C)OC(=O)C)C)OC(=O)C3=C)O |
| InChIKey | UZTYOOVAPGOQDZ-UHFFFAOYSA-N |
Product Overview
EUPATOCUNOXIN (CAS 39204-36-9), with molecular formula C22H28O8 and molecular weight 420.18 g/mol. IUPAC: (9-acetyloxy-4-hydroxy-6,10-dimethyl-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-5-yl) 2,3-dimethyloxirane-2-carboxylate.
Chemical Property Profile of EUPATOCUNOXIN
Property Insights of EUPATOCUNOXIN
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for EUPATOCUNOXIN. The TPSA of 112.0 Ų falls within the moderate polarity range, balancing permeability and solubility for EUPATOCUNOXIN. Following Lipinski's Rule of Five, EUPATOCUNOXIN has 1 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 EUPATOCUNOXIN?
The CAS number of EUPATOCUNOXIN is 39204-36-9.
What is the molecular formula of EUPATOCUNOXIN?
The molecular formula of EUPATOCUNOXIN is C22H28O8.
What is the molecular weight of EUPATOCUNOXIN?
The molecular weight of EUPATOCUNOXIN is 420.18 g/mol.
Where can I buy EUPATOCUNOXIN?
You can request a quote for EUPATOCUNOXIN directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for EUPATOCUNOXIN?
Yes, KEHONG BIO provides custom synthesis services for EUPATOCUNOXIN and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.