| Phytochemical Name : 8-Hydroxybergapten |
| PCNDIDOT1042 |
| Pubchem CID : 3083726 |
| Molecular formula: C12H8O5 |
| Canonical SMILES : COC1=C2C=COC2=C(C3=C1C=CC(=O)O3)O |
Synonymes : 8-Hydroxybergapten|1603-47-0|9-Hydroxy-4-methoxypsoralen|9-HYDROXY-4-METHOXY-PSORALEN|9-hydroxy-4-methoxyfuro[3,2-g]chromen-7-one|KBZ9E8KHG6|UNII-KBZ9E8KHG6|7H-Furo(3,2-g)(1)benzopyran-7-one, 9-hydroxy-4-methoxy-|CHEMBL1934069|C12H8O5|7H-Furo[3,2-g][1]benzopyran-7-one, 9-hydroxy-4-methoxy-|9-Hydroxybergapten|9-Hydroxy-5-methoxypsoralen|5-Methoxy-8-hydroxy-psoralen|SCHEMBL6361059|MVJHUMZXIJPVHV-UHFFFAOYSA-|DTXSID20166854|CHEBI:174187|BAA60347|HY-N6010|BDBM50361383|AKOS000277887|MS-23324|CS-0032148|FT-0775442|9-hydroxy-4-methoxyuro[3,2-g]chromen-7-one|E88624|9-hydroxy-5-methoxy-2H-furo[3,2-g]chromen-2-one|4-METHOXY-9-OXIDANYL-FURO(3,2-G)CHROMEN-7-ONE|9-Hydroxy-4-methoxy-7H-Furo(3,2-g)(1)benzopyran-7-one|9-HYDROXY-4-METHOXY-7H-FURO[3,2-G]CHROMEN-7-ONE|9-Hydroxy-4-methoxyfuro[3,2-g][1]benzopyran-7-one, 9CI|5-Benzofuranacrylic acid, 6,7-dihydroxy-4-methoxy-, delta-lactone |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 1.960 |
| Log Po/w (XLOGP3) : 1.570 |
| Log Po/w (WLOGP) : 2.250 |
| Log Po/w (MLOGP) : 0.610 |
| Log Po/w (SILICOS-IT) : 2.380 |
| Consensus Log Po/w : 1.750 |