Eupatundin
TL;DR: Eupatundin (CAS 20071-53-8) is a chemical compound with molecular formula C20H24O7 and molecular weight 376.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(1R,2S,6R,7R,10R,11S,12R,14R)-1,11-dihydroxy-14-methyl-5,9-dimethylidene-4-oxo-3,13-dioxatetracyclo[8.4.0.02,6.012,14]tetradecan-7-yl] (Z)-2-methylbut-2-enoate
Also Known As: [(1R,2S,6R,7R,10R,11S,12R,14R)-1,11-dihydroxy-14-methyl-5,9-dimethylidene-4-oxo-3,13-dioxatetracyclo[8.4.0.02,6.012,14]tetradecan-7-yl] (Z)-2-methylbut-2-enoate|(1R,2S,6R,7R,10R,11S,12R,14R)-1,11-dihydroxy-14-methyl-5,9-dimethylidene-4-oxo-3,13-dioxatetracyclo[8.4.0.02,6.012,14]tetradecan-7-yl (2Z)-2-methylbut-2-enoate|(3aR,4R,6aR,7S,7aR,8aR,8bR,8cS)-7,8b-Dihydroxy-8a-methyl-3,6-dimethylidene-2-oxododecahydrooxireno[2,3]azuleno[4,5-b]furan-4-yl (2Z)-2-methylbut-2-enoate|(Z)-2-Methyl-2-butenoic acid (3aR,6abeta,7aalpha,8calpha)-dodecahydro-7alpha,8bbeta-dihydroxy-8aalpha-methyl-3,6-bis(methylene)-2-oxooxireno[2,3]azuleno[4,5-b]furan-4alpha-yl ester|EUPATUNDIN|MLS002706562
| Molecular Formula | C20H24O7 |
|---|---|
| Molecular Weight | 376.15 g/mol |
| LogP | 0.8014 |
| Topological Polar Surface Area | 105.59 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 376.1522 |
| Heavy Atoms | 27 |
| Complexity | 798.1519 |
Chemical Identifiers
| CAS Number | 20071-53-8 |
|---|---|
| SMILES | C/C=C(/C)\C(=O)O[C@@H]1CC(=C)[C@@H]2[C@@H]([C@@H]3[C@]([C@@]2([C@@H]4[C@@H]1C(=C)C(=O)O4)O)(O3)C)O |
Product Overview
Eupatundin (CAS 20071-53-8), with molecular formula C20H24O7 and molecular weight 376.15 g/mol. IUPAC: [(1R,2S,6R,7R,10R,11S,12R,14R)-1,11-dihydroxy-14-methyl-5,9-dimethylidene-4-oxo-3,13-dioxatetracyclo[8.4.0.02,6.012,14]tetradecan-7-yl] (Z)-2-methylbut-2-enoate.
Chemical Property Profile of Eupatundin
Property Insights of Eupatundin
The XLogP value of 0.8014 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Eupatundin. The TPSA of 105.59 Ų falls within the moderate polarity range, balancing permeability and solubility for Eupatundin. Following Lipinski's Rule of Five, Eupatundin has 2 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 Eupatundin?
The CAS number of Eupatundin is 20071-53-8.
What is the molecular formula of Eupatundin?
The molecular formula of Eupatundin is C20H24O7.
What is the molecular weight of Eupatundin?
The molecular weight of Eupatundin is 376.15 g/mol.
Where can I buy Eupatundin?
You can request a quote for Eupatundin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Eupatundin?
Yes, KEHONG BIO provides custom synthesis services for Eupatundin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.