Armillaripin
TL;DR: Armillaripin (CAS 151222-01-4) 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.
[(2R,2aR,4aR,7aR,7bS)-3-formyl-4a-hydroxy-6,6,7b-trimethyl-1,2,2a,5,7,7a-hexahydrocyclobuta[e]inden-2-yl] 2-hydroxy-4-methoxy-6-methylbenzoate
Also Known As: Armillaripin, KST-1A1590, (2r,2ar,4ar,7ar,7bs)-3-formyl-4a-hydroxy-6,6,7b-trimethyl-2,2a,4a,5,6,7,7a,7b-octahydro-1h-cyclobuta[e]inden-2-yl 2-hydroxy-4-methoxy-6-methylbenzoate, [(2R,2aR,4aR,7aR,7bS)-3-formyl-4a-hydroxy-6,6,7b-trimethyl-1,2,2a,5,7,7a-hexahydrocyclobuta[e]inden-2-yl] 2-hydroxy-4-methoxy-6-methylbenzoate, 4-Ethyl-N-(3,4,5-trimethoxybenzyl)aniline hydrochloride
Technical Specifications
| Molecular Formula | C24H30O6 |
| Molecular Weight | 414.20422 g/mol |
| XLogP | 3.9 |
| Topological Polar Surface Area (TPSA) | 93.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 414.20422 Da |
| Heavy Atoms | 30 |
| Complexity | 759.0 |
| SMILES | CC1=CC(=CC(=C1C(=O)O[C@@H]2C[C@]3([C@@H]2C(=C[C@]4([C@@H]3CC(C4)(C)C)O)C=O)C)O)OC |
| InChIKey | BGKXQRPQNIXIMH-MEVKZITKSA-N |
Chemical Property Profile of Armillaripin
Property Insights of Armillaripin
The XLogP value of 3.9 indicates that Armillaripin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Armillaripin. Following Lipinski's Rule of Five, Armillaripin 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 Armillaripin?
The CAS number of Armillaripin is 151222-01-4.
What is the molecular formula of Armillaripin?
The molecular formula of Armillaripin is C24H30O6.
What is the molecular weight of Armillaripin?
The molecular weight of Armillaripin is 414.20422 g/mol.
Where can I buy Armillaripin?
You can request a quote for Armillaripin directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Armillaripin?
Yes, CoreyChem provides custom synthesis services for Armillaripin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.