| Phytochemical Name : Coumarin 343 |
| PCNDIDC0264 |
| Pubchem CID : 108770 |
| Molecular formula: C16H15NO4 |
| Canonical SMILES : C1CC2=C3C(=C4C(=C2)C=C(C(=O)O4)C(=O)O)CCCN3C1 |
Synonymes : Coumarin 343|55804-65-4|11-oxo-2,3,5,6,7,11-Hexahydro-1H-pyrano[2,3-f]pyrido[3,2,1-ij]quinoline-10-carboxylic acid|Coumarin 519|Coumarin 343 acid|EINECS 259-824-6|7GE3Q7LWR9|CHEMBL2442512|CHEBI:51941|2,3,6,7-tetrahydro-11-oxo-1h,5h,11h-[1]benzopyrano[6,7,8-ij]quinolizine-10-carboxylic acid|4-oxo-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraene-5-carboxylic acid|11-oxo-2,3,6,7-tetrahydro-1H,5H,11H-pyrano[2,3-f]pyrido[3,2,1-ij]quinoline-10-carboxylic acid|1H,5H,11H-(1)Benzopyrano(6,7,8-ij)quinolizine-10-carboxylic acid, 2,3,6,7-tetrahydro-11-oxo-|1H,5H,11H-[1]Benzopyrano[6,7,8-ij]quinolizine-10-carboxylic acid, 2,3,6,7-tetrahydro-11-oxo-|2,3,6,7-Tetrahydro-11-oxo-1H,5H,11H-(1)benzopyrano(6,7,8-ij)quinolizine-10-carboxylic acid|MFCD00051335|1h,5h,11h-[1]benzopyrano[6,7,8-ij]quinolizine-10-carboxylicacid, 2,3,6,7-tetrahydro-11-oxo-|coumarin-343|ST069309|UNII-7GE3Q7LWR9|Oprea1_370773|SCHEMBL45609|LCZC362|DTXSID9069051|AMY31162|Coumarin 343, Dye content 97 %|BDBM50442718|STK409686|AKOS000805664|BP-27942|BS-17241|C2899|CS-0312751|A11569|Q27123015|F3308-1839|1H,5H,11H-[1]benzopyrano[6,7,8-ij]quinolizine-10-carboxylic?acid, 2,3,6,7-tetrahydro-11-oxo-|1H,5H,11H-[1]benzopyrano[6,7,8-ij]quinolizine-10-carboxylic?acid,2,3,6,7-tetrahydro-11-oxo- |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 1.860 |
| Log Po/w (XLOGP3) : 3.100 |
| Log Po/w (WLOGP) : 1.810 |
| Log Po/w (MLOGP) : 2.280 |
| Log Po/w (SILICOS-IT) : 2.810 |
| Consensus Log Po/w : 2.370 |