TL;DR: Manoalogue (CAS 136440-42-1) is a chemical compound with molecular formula C19H26O4 and molecular weight 318.1831 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2E,4E)-2-[3-(2-hydroxy-5-oxo-2H-furan-3-yl)propylidene]-5,9-dimethyldeca-4,8-dienal
Also Known As: Manoalogue, (2E,4E)-2-[3-(2-hydroxy-5-oxo-2H-furan-3-yl)propylidene]-5,9-dimethyldeca-4,8-dienal, 5-Hydroxy-4-[(3E,6E)-4-formyl-7,11-dimethyl-3,6,10-dodecatrien-1-yl]furan-2(5H)-one, (2E,4E)-2-[3-(2-hydroxy-5-oxo-2,5-dihydrofuran-3-yl)propylidene]-5,9-dimethyldeca-4,8-dienal, 4,8-DECADIENAL, 2-(3-(2,5-DIHYDRO-2-HYDROXY-5-OXO-3-FURANYL)PROPYLIDENE)-5,9-DIMETHYL-, (2E,4E)-
| Molecular Formula | C19H26O4 |
| Molecular Weight | 318.1831 g/mol |
| XLogP | 3.5 |
| Topological Polar Surface Area (TPSA) | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 318.1831 Da |
| Heavy Atoms | 23 |
| Complexity | 546.0 |
| SMILES | CC(=CCC/C(=C/C/C(=C\CCC1=CC(=O)OC1O)/C=O)/C)C |
| InChIKey | HTSFZYLQNVNCQC-QJPCTQKWSA-N |
The XLogP value of 3.5 indicates that Manoalogue is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Manoalogue. Following Lipinski's Rule of Five, Manoalogue has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Manoalogue is 136440-42-1.
The molecular formula of Manoalogue is C19H26O4.
The molecular weight of Manoalogue is 318.1831 g/mol.
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