| Phytochemical Name : Laudanosoline |
| PCNDIDL0018 |
| Pubchem CID : 92716 |
| Molecular formula: C17H19NO4 |
| Canonical SMILES : CN1CCC2=CC(=C(C=C2C1CC3=CC(=C(C=C3)O)O)O)O |
Synonymes : Laudanosoline|485-33-6|(R,S)-Laudanosoline|1-(3,4-dihydroxybenzyl)-2-methyl-1,2,3,4-tetrahydroisoquinoline-6,7-diol|DL-LAUDANOSOLINE HYDROBROMIDE TRIHYDRATE|EINECS 260-635-6|1-[(3,4-dihydroxyphenyl)methyl]-2-methyl-3,4-dihydro-1H-isoquinoline-6,7-diol|CHEMBL19844|CHEBI:31764|EINECS 207-613-4|EINECS 281-783-8|C17H19NO4.BrH|(S)-1-((3,4-Dihydroxyphenyl)methyl)-1,2,3,4-tetrahydro-2-methylisoquinoline-6,7-diol|DL-6,7-Dimethoxy-1-((3,4-dimethoxyphenyl)methyl)-2-methylisoquinoline hydrobromide trihydrate|(1)-1-((3,4-Dihydroxyphenyl)methyl)-1,2,3,4-tetrahydro-2-methylisoquinoline-6,7-diol hydrobromide|(S)-1-[(3,4-DIHYDROXYPHENYL)METHYL]-1,2,3,4-TETRAHYDRO-2-METHYLISOQUINOLINE-6,7-DIOL|C17-H19-N-O4.Br-H|(+-)-1-[(3,4-dihydroxyphenyl)methyl]-1,2,3,4-tetrahydro-2-methylisoquinoline-6,7-diol hydrobromide|ST50307991|Oprea1_429345|D,L-laudanosoline (JW9-3)|SCHEMBL13356020|DTXSID60964073|BDBM50291683|NSC 99800|AKOS024306970|NCGC00163586-01|FT-0632201|SR-05000002260|SR-05000002260-2|Q27114681|1-(3,4-Dihydroxy-benzyl)-2-methyl-1,2,3,4-tetrahydro-isoquinoline-6,7-diol|1-(3,4-Dihydroxybenzyl)-2-methyl-1,2,3,4-tetrahydro-6,7-isoquinolinediol #|1-[(3,4-dihydroxyphenyl)methyl]-2-methyl-1,2,3,4-tetrahydroisoquinoline-6,7-diol|6,7-Isoquinolinediol, 1-[(3,4-dihydroxyphenyl)methyl]-1,2,3,4-tetrahydro-2-methyl- |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 2.070 |
| Log Po/w (XLOGP3) : 2.360 |
| Log Po/w (WLOGP) : 1.580 |
| Log Po/w (MLOGP) : 1.280 |
| Log Po/w (SILICOS-IT) : 1.860 |
| Consensus Log Po/w : 1.830 |