| Phytochemical Name : Aloesone |
| PCNDIDA0070 |
| Pubchem CID : 5317700 |
| Molecular formula: C13H12O4 |
| Canonical SMILES : CC1=CC(=CC2=C1C(=O)C=C(O2)CC(=O)C)O |
Synonymes : Aloesone|40738-40-7|UNII-5O7KO4M2YY|5O7KO4M2YY|2-Acetonyl-7-hydroxy-5-methyl-chromen-4-one|2-actonyl-7-hydroxy-5-methylchromone|2-(2-Oxopropyl)-7-hydroxy-5-methyl-4H-1-benzopyran-4-one|5-methyl-7-hydroxy-2-(2'oxopropyl)chromone|7-hydroxy-5-methyl-2-(2-oxopropyl)-4H-chromen-4-one|CHEBI:59878|DTXSID20193721|2-acetonyl-7-hydroxy-5-methylchromone|F78279|Q27126933|4H-1-Benzopyran-4-one, 7-hydroxy-5-methyl-2-(2-oxopropyl)- |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 1.810 |
| Log Po/w (XLOGP3) : 1.180 |
| Log Po/w (WLOGP) : 1.940 |
| Log Po/w (MLOGP) : 0.440 |
| Log Po/w (SILICOS-IT) : 3.130 |
| Consensus Log Po/w : 1.700 |