| Phytochemical Name : Cnidilin |
| PCNDIDC0209 |
| Pubchem CID : 821449 |
| Molecular formula: C17H16O5 |
| Canonical SMILES : CC(=CCOC1=C2C=COC2=C(C3=C1C=CC(=O)O3)OC)C |
Synonymes : Cnidilin|Isophellopterin|14348-22-2|Knidilin|GGS6U48RG7|CHEMBL1934194|9-methoxy-4-(3-methylbut-2-enoxy)furo[3,2-g]chromen-7-one|CHEBI:81139|5-(Isopentenyloxy)-8-methoxypsoralen|7H-Furo(3,2-g)(1)benzopyran-7-one, 9-methoxy-4-((3-methyl-2-buten-1-yl)oxy)-|kinidilin|UNII-GGS6U48RG7|HY-N2272|BDBM50361387|MFCD32004085|AKOS037514593|CS-0019601|FT-0775415|C17503|Q27155096|9-Methoxy-4-((3-methylbut-2-en-1-yl)oxy)-7H-furo[3,2-g]chromen-7-one |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 3.270 |
| Log Po/w (XLOGP3) : 3.470 |
| Log Po/w (WLOGP) : 3.890 |
| Log Po/w (MLOGP) : 1.820 |
| Log Po/w (SILICOS-IT) : 4.040 |
| Consensus Log Po/w : 3.300 |