| Phytochemical Name : Lunularic acid |
| PCNDIDL0099 |
| Pubchem CID : 161413 |
| Molecular formula: C15H14O4 |
| Canonical SMILES : C1=CC(=C(C(=C1)O)C(=O)O)CCC2=CC=C(C=C2)O |
Synonymes : Lunularic acid|23255-59-6|2-Hydroxy-6-(4-hydroxyphenethyl)benzoic acid|Benzoic acid, 2-hydroxy-6-[2-(4-hydroxyphenyl)ethyl]-|2-Hydroxy-6-(2-(4-hydroxyphenyl)ethyl)benzoic acid|6-(p-hydroxyphenethyl)salicylic acid|2-hydroxy-6-[2-(4-hydroxyphenyl)ethyl]benzoic acid|UNII-9ZQ3FYV21C|9ZQ3FYV21C|Benzoic acid, 2-hydroxy-6-(2-(4-hydroxyphenyl)ethyl)-|CHEBI:6567|Lunularsaure|LUNULARIC ACID [MI]|SCHEMBL574679|CHEMBL240495|DTXSID40177826|YAA25559|LMPK13090038|MFCD24368585|AKOS028108643|AS-69280|2-Hydroxy-6-(4-hydroxyphenethyl)benzoicacid|2-(4-hydroxyphenethyl)-6-hydroxybenzoic acid|Q6704485 |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 1.360 |
| Log Po/w (XLOGP3) : 3.510 |
| Log Po/w (WLOGP) : 2.580 |
| Log Po/w (MLOGP) : 2.470 |
| Log Po/w (SILICOS-IT) : 2.650 |
| Consensus Log Po/w : 2.520 |