| Phytochemical Name : Nymphaeol A |
| PCNDIDN0111 |
| Pubchem CID : 639465 |
| Molecular formula: C25H28O6 |
| Canonical SMILES : CC(=CCCC(=CCC1=C(C2=C(C=C1O)OC(CC2=O)C3=CC(=C(C=C3)O)O)O)C)C |
Synonymes : NYMPHAEOL A|Propolin C|CHEBI:66640|73676-38-7|6-geranyl-3',4',5,7-tetrahydroxyflavanone|(2S)-2-(3,4-dihydroxyphenyl)-6-[(2E)-3,7-dimethylocta-2,6-dien-1-yl]-5,7-dihydroxy-2,3-dihydro-4H-chromen-4-one|CHEMBL223256|SCHEMBL7795014|SCHEMBL16105856|BDBM50380205|(2S)-2-(3,4-dihydroxyphenyl)-6-[(2E)-3,7-dimethylocta-2,6-dienyl]-5,7-dihydroxy-2,3-dihydrochromen-4-one|Q27135257|2-(3,4-dihydroxyphenyl)-6-(3,7-dimethylocta-2,6-dien-1-yl)-5,7-dihydroxy-2,3-dihydro-4H-chromen-4-one|4H-1-benzopyran-4-one, 2-(3,4-dihydroxyphenyl)-6-(3,7-dimethyl-2,6-octadienyl)-2,3-dihydro-5,7-dihydroxy-, (2S)- |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 3.930 |
| Log Po/w (XLOGP3) : 5.800 |
| Log Po/w (WLOGP) : 5.130 |
| Log Po/w (MLOGP) : 2.280 |
| Log Po/w (SILICOS-IT) : 4.950 |
| Consensus Log Po/w : 4.420 |