alpha-Peroxyachifolid
TL;DR: alpha-Peroxyachifolid (CAS 134954-21-5) is a chemical compound with molecular formula C20H24O7 and molecular weight 376.1522 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(2R,3R,5S,9S,11S)-3-hydroxy-2,11-dimethyl-6-methylidene-7-oxo-8,12,13-trioxatetracyclo[9.2.2.01,10.05,9]pentadec-14-en-2-yl] (E)-2-methylbut-2-enoate
Also Known As: alpha-Peroxyachifolid, -Peroxyachifolid, Alpha-peroxy-achifolid, 2-Butenoic acid, 2-methyl-, 2,3,3a,5,6,9,9a,9b-octahydro-5-hydroxy-6,9-dimethyl-3-methylene-2-oxo-4H-6a,9-ethenofuro(2',3':3,4)cyclohepta(1,2-c)(1,2)dioxol-6-yl ester, (3aS-(3aalpha,5alpha,6alpha(E),6abeta,9beta,9aalpha,9bbeta))-, ((2R,3R,5S,9S,11S)-3-hydroxy-2,11-dimethyl-6-methylidene-7-oxo-8,12,13-trioxatetracyclo(9.2.2.01,10.05,9)pentadec-14-en-2-yl) (E)-2-methylbut-2-enoate
Technical Specifications
| Molecular Formula | C20H24O7 |
| Molecular Weight | 376.1522 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 91.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 376.1522 Da |
| Heavy Atoms | 27 |
| Complexity | 798.0 |
| SMILES | C/C=C(\C)/C(=O)O[C@@]1([C@@H](C[C@@H]2[C@@H](C3C14C=C[C@@]3(OO4)C)OC(=O)C2=C)O)C |
| InChIKey | UMHHYRUGXILZJB-MVKXAPRWSA-N |
Chemical Property Profile of alpha-Peroxyachifolid
Property Insights of alpha-Peroxyachifolid
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for alpha-Peroxyachifolid. The TPSA of 91.3 Ų falls within the moderate polarity range, balancing permeability and solubility for alpha-Peroxyachifolid. Following Lipinski's Rule of Five, alpha-Peroxyachifolid has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of alpha-Peroxyachifolid?
The CAS number of alpha-Peroxyachifolid is 134954-21-5.
What is the molecular formula of alpha-Peroxyachifolid?
The molecular formula of alpha-Peroxyachifolid is C20H24O7.
What is the molecular weight of alpha-Peroxyachifolid?
The molecular weight of alpha-Peroxyachifolid is 376.1522 g/mol.
Where can I buy alpha-Peroxyachifolid?
You can request a quote for alpha-Peroxyachifolid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for alpha-Peroxyachifolid?
Yes, CoreyChem provides custom synthesis services for alpha-Peroxyachifolid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.