TL;DR: Hyphodontal (CAS 159736-40-0) is a chemical compound with molecular formula C15H18O4 and molecular weight 262.1205 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(1S,7S,9S,12R)-12-hydroxy-5,5-dimethyl-10-oxo-11-oxatetracyclo[7.3.1.01,9.03,7]tridec-2-ene-2-carbaldehyde
Also Known As: Hyphodontal, ALQBGFIXBVZYPH-AZEZGGBOSA-, KST-1A1855, hydroxy-dimethyl-oxo-[?]carbaldehyde, 5(2H)-Oxazolone,2,2-dimethyl-,3-oxide
| Molecular Formula | C15H18O4 |
| Molecular Weight | 262.1205 g/mol |
| XLogP | 0.9 |
| Topological Polar Surface Area (TPSA) | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 262.1205 Da |
| Heavy Atoms | 19 |
| Complexity | 546.0 |
| SMILES | CC1(C[C@H]2C[C@]34C[C@]3([C@@H](OC4=O)O)C(=C2C1)C=O)C |
| InChIKey | ALQBGFIXBVZYPH-AZEZGGBOSA-N |
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Hyphodontal. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Hyphodontal. Following Lipinski's Rule of Five, Hyphodontal 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 Hyphodontal is 159736-40-0.
The molecular formula of Hyphodontal is C15H18O4.
The molecular weight of Hyphodontal is 262.1205 g/mol.
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