TL;DR: Costunolide (CAS 125514-73-0) is a chemical compound with molecular formula C15H20O2 and molecular weight 232.14633 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3aS,6Z,10Z,11aR)-6,10-dimethyl-3-methylidene-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-2-one
Also Known As: Costunolide, Costunlide, Costunolid, Costus lactone, (+)-costunolide
| Molecular Formula | C15H20O2 |
| Molecular Weight | 232.14633 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 232.14633 Da |
| Heavy Atoms | 17 |
| Complexity | 401.0 |
| SMILES | C/C/1=C/CC/C(=C\[C@@H]2[C@@H](CC1)C(=C)C(=O)O2)/C |
| InChIKey | HRYLQFBHBWLLLL-IKTIWSOHSA-N |
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Costunolide. With a topological polar surface area (TPSA) of 26.3 Ų, Costunolide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Costunolide has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Costunolide is 125514-73-0.
The molecular formula of Costunolide is C15H20O2.
The molecular weight of Costunolide is 232.14633 g/mol.
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