3,5-Dihydroxy-19-oxo-14,15-epoxybufa-20,22-dienolide
TL;DR: 3,5-Dihydroxy-19-oxo-14,15-epoxybufa-20,22-dienolide (CAS 562-21-0) is a chemical compound with molecular formula C24H30O6 and molecular weight 414.20422 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S,4R,6R,7R,11S,14S,16S)-14,16-dihydroxy-7-methyl-6-(6-oxopyran-3-yl)-3-oxapentacyclo[8.8.0.02,4.02,7.011,16]octadecane-11-carbaldehyde
Also Known As: Bufotalinin, 4-19-00-03021 (Beilstein Handbook Reference), 3,5-Dihydroxy-19-oxo-14,15-epoxybufa-20,22-dienolide, 3-beta,5-Dihydroxy-14,15-beta-epoxy-19-oxo-5-beta-bufa-20,22-dienolide, 5-beta-BUFA-20,22-DIENOLIDE, 3-beta,5-DIHYDROXY-14,15-beta-EPOXY-19-OXO-
Technical Specifications
| Molecular Formula | C24H30O6 |
| Molecular Weight | 414.20422 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 96.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 414.20422 Da |
| Heavy Atoms | 30 |
| Complexity | 879.0 |
| SMILES | C[C@]12CCC3C([C@@]14[C@H](O4)C[C@@H]2C5=COC(=O)C=C5)CC[C@]6([C@@]3(CC[C@@H](C6)O)C=O)O |
| InChIKey | TYFUTHRVUVOENP-SHFSIXQYSA-N |
Product Description
Applications: 3,5-Dihydroxy-19-oxo-14,15-epoxybufa-20,22-dienolide is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
A fine chemical supplied by CoreyChem, 3,5-Dihydroxy-19-oxo-14,15-epoxybufa-20,22-dienolide (CAS 562-21-0) has the molecular formula C24H30O6 and a molecular weight of 414.2 g/mol. Synonyms include Bufotalinin and 4-19-00-03021 (Beilstein Handbook Reference).
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of 3,5-Dihydroxy-19-oxo-14,15-epoxybufa-20,22-dienolide
Property Insights of 3,5-Dihydroxy-19-oxo-14,15-epoxybufa-20,22-dienolide
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,5-Dihydroxy-19-oxo-14,15-epoxybufa-20,22-dienolide. The TPSA of 96.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,5-Dihydroxy-19-oxo-14,15-epoxybufa-20,22-dienolide. Following Lipinski's Rule of Five, 3,5-Dihydroxy-19-oxo-14,15-epoxybufa-20,22-dienolide has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3,5-Dihydroxy-19-oxo-14,15-epoxybufa-20,22-dienolide?
The CAS number of 3,5-Dihydroxy-19-oxo-14,15-epoxybufa-20,22-dienolide is 562-21-0.
What is the molecular formula of 3,5-Dihydroxy-19-oxo-14,15-epoxybufa-20,22-dienolide?
The molecular formula of 3,5-Dihydroxy-19-oxo-14,15-epoxybufa-20,22-dienolide is C24H30O6.
What is the molecular weight of 3,5-Dihydroxy-19-oxo-14,15-epoxybufa-20,22-dienolide?
The molecular weight of 3,5-Dihydroxy-19-oxo-14,15-epoxybufa-20,22-dienolide is 414.20422 g/mol.
What are the applications of 3,5-Dihydroxy-19-oxo-14,15-epoxybufa-20,22-dienolide?
3,5-Dihydroxy-19-oxo-14,15-epoxybufa-20,22-dienolide is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical...
Where can I buy 3,5-Dihydroxy-19-oxo-14,15-epoxybufa-20,22-dienolide?
You can request a quote for 3,5-Dihydroxy-19-oxo-14,15-epoxybufa-20,22-dienolide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3,5-Dihydroxy-19-oxo-14,15-epoxybufa-20,22-dienolide?
Yes, CoreyChem provides custom synthesis services for 3,5-Dihydroxy-19-oxo-14,15-epoxybufa-20,22-dienolide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.