| Phytochemical Name : Crotin |
| PCNDIDC0270 |
| Pubchem CID : 11473265 |
| Molecular formula: C20H20O5 |
| Canonical SMILES : CC1(C=CC2=C(O1)C=CC(=C2O)C(=O)CCC3=CC(=C(C=C3)O)O)C |
Synonymes : Crotin|Crotin (chalcone)|2DZ0T25OEG|255831-48-2|UNII-2DZ0T25OEG|1-Propanone, 3-(3,4-dihydroxyphenyl)-1-(5-hydroxy-2,2-dimethyl-2H-1-benzopyran-6-yl)-|3-(3,4-Dihydroxyphenyl)-1-(5-hydroxy-2,2-dimethyl-2H-1-benzopyran-6-yl)-1-propanone|3,4,2'-Trihydroxy-6'',6''-dimethylpyrano[2'',3'':4',3']dihydrochalcone|CHEMBL181576|LMPK12120457|3-(3,4-dihydroxyphenyl)-1-(5-hydroxy-2,2-dimethyl-chromen-6-yl)propan-1-one|Q27896513 |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 2.820 |
| Log Po/w (XLOGP3) : 3.900 |
| Log Po/w (WLOGP) : 3.690 |
| Log Po/w (MLOGP) : 1.820 |
| Log Po/w (SILICOS-IT) : 3.630 |
| Consensus Log Po/w : 3.170 |