TL;DR: Arohynapene A (CAS 154445-08-6) is a chemical compound with molecular formula C18H22O3 and molecular weight 286.1569 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2E,4E)-5-(5-hydroxy-2,6,8-trimethyl-5,6,7,8-tetrahydronaphthalen-1-yl)penta-2,4-dienoic acid
Also Known As: Arohynapene A, (2E,4E)-5-(5-hydroxy-2,6,8-trimethyl-5,6,7,8-tetrahydronaphthalen-1-yl)penta-2,4-dienoic acid, 5-(5-Hydroxy-2,6,8-trimethyl-5,6,7,8-tetrahydronaphthalene)-2,4-pentadienoic acid, 2,4-Pentadienoic acid, 5-(5,6,7,8-tetrahydro-5-hydroxy-2,6,8-trimethyl-1-naphthalenyl)-, (2E,4E)-5-[(5,6,7,8-Tetrahydro-5-hydroxy-2,6,8-trimethylnaphthalen)-1-yl]-2,4-pentadienoic acid
| Molecular Formula | C18H22O3 |
| Molecular Weight | 286.1569 g/mol |
| XLogP | 3.5 |
| Topological Polar Surface Area (TPSA) | 57.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 286.1569 Da |
| Heavy Atoms | 21 |
| Complexity | 426.0 |
| SMILES | CC1CC(C2=C(C1O)C=CC(=C2/C=C/C=C/C(=O)O)C)C |
| InChIKey | LPDVNGOVYMGORG-YDFGWWAZSA-N |
The XLogP value of 3.5 indicates that Arohynapene A is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.5 Ų, Arohynapene A exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Arohynapene A has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Arohynapene A is 154445-08-6.
The molecular formula of Arohynapene A is C18H22O3.
The molecular weight of Arohynapene A is 286.1569 g/mol.
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