Epoxyazadiradione
TL;DR: Epoxyazadiradione (CAS 18385-59-6) is a chemical compound with molecular formula C28H34O6 and molecular weight 466.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(1S,2R,4S,10R,11R,16R)-6-(furan-3-yl)-1,7,11,15,15-pentamethyl-5,14-dioxo-3-oxapentacyclo[8.8.0.02,4.02,7.011,16]octadec-12-en-18-yl] acetate
Also Known As: Epoxyazadiradione, (3-furyl-pentamethyl-dioxo-[?]yl) acetate, [(1S,2R,4S,10R,11R,16R)-6-(Furan-3-yl)-1,7,11,15,15-pentamethyl-5,14-dioxo-3-oxapentacyclo[8.8.0.02,4.02,7.011,16]octadec-12-en-18-yl] acetate, (5alpha,7alpha,13alpha,14beta,15beta,17alpha)-7-(Acetyloxy)-14,15:21,23-diepoxy-4,4,8-trimethyl-24-norchola-1,20,22-triene-3,16-dione, 17-(Furan-3-yl)-4,4,8-trimethyl-3,16-dioxo-14,15-epoxyandrost-1-en-7-yl acetate
| Molecular Formula | C28H34O6 |
|---|---|
| Molecular Weight | 466.24 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 86.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 466.23553 |
| Heavy Atoms | 34 |
| Complexity | 1010.0 |
Chemical Identifiers
| CAS Number | 18385-59-6 |
|---|---|
| SMILES | CC(=O)OC1C[C@@H]2[C@](C=CC(=O)C2(C)C)([C@@H]3[C@@]1([C@]45[C@H](O4)C(=O)C(C5(CC3)C)C6=COC=C6)C)C |
| InChIKey | NEYCGDYQBQONFC-AMVLTCCSSA-N |
Product Overview
Epoxyazadiradione (CAS 18385-59-6), with molecular formula C28H34O6 and molecular weight 466.24 g/mol. IUPAC: [(1S,2R,4S,10R,11R,16R)-6-(furan-3-yl)-1,7,11,15,15-pentamethyl-5,14-dioxo-3-oxapentacyclo[8.8.0.02,4.02,7.011,16]octadec-12-en-18-yl] acetate.
Chemical Property Profile of Epoxyazadiradione
Property Insights of Epoxyazadiradione
The XLogP value of 4.2 indicates that Epoxyazadiradione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Epoxyazadiradione. Following Lipinski's Rule of Five, Epoxyazadiradione has 0 hydrogen bond donor(s) and 6 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 Epoxyazadiradione?
The CAS number of Epoxyazadiradione is 18385-59-6.
What is the molecular formula of Epoxyazadiradione?
The molecular formula of Epoxyazadiradione is C28H34O6.
What is the molecular weight of Epoxyazadiradione?
The molecular weight of Epoxyazadiradione is 466.24 g/mol.
Where can I buy Epoxyazadiradione?
You can request a quote for Epoxyazadiradione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Epoxyazadiradione?
Yes, KEHONG BIO provides custom synthesis services for Epoxyazadiradione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.