TL;DR: Gigantenone (CAS 125140-03-6) is a chemical compound with molecular formula C15H20O4 and molecular weight 264.13617 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(1aS,6R,7R,7aR,7bR)-6-hydroxy-7,7a-dimethyl-1a-[(2R)-2-methyloxiran-2-yl]-5,6,7,7b-tetrahydro-4H-naphtho[1,2-b]oxiren-2-one
Also Known As: Gigantenone, (+)-Gigantenone, (1aS,6R,7R,7aR,7bR)-6-hydroxy-7,7a-dimethyl-1a-[(2R)-2-methyloxiran-2-yl]-5,6,7,7b-tetrahydro-4H-naphtho[1,2-b]oxiren-2-one, (1aS,6R,7R,7aR,7bR)-6-hydroxy-7,7a-dimethyl-1a-((2R)-2-methyloxiran-2-yl)-5,6,7,7b-tetrahydro-4H-naphtho(1,2-b)oxiren-2-one, (1aS,6R,7R,7aR,7bR)-6-hydroxy-7,7a-dimethyl-1a-[(2R)-2-methyloxiran-2-yl]-1aH,2H,4H,5H,6H,7H,7aH,7bH-naphtho[1,2-b]oxiren-2-one
| Molecular Formula | C15H20O4 |
| Molecular Weight | 264.13617 g/mol |
| XLogP | 0.5 |
| Topological Polar Surface Area (TPSA) | 62.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 264.13617 Da |
| Heavy Atoms | 19 |
| Complexity | 512.0 |
| SMILES | C[C@H]1[C@@H](CCC2=CC(=O)[C@]3([C@@H]([C@]12C)O3)[C@]4(CO4)C)O |
| InChIKey | HKPKDBKOAYLOQF-OCZRQZLOSA-N |
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Gigantenone. The TPSA of 62.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Gigantenone. Following Lipinski's Rule of Five, Gigantenone 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 Gigantenone is 125140-03-6.
The molecular formula of Gigantenone is C15H20O4.
The molecular weight of Gigantenone is 264.13617 g/mol.
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