1,2,3,4-Tetrahydro-6,7-dihydroxyisoquinoline
AlkaPlorer ID: AK079955
Synonym: 1,2,3,4-Tetrahydro-6,7-isoquinolinediol, Norsalsolinol
IUPAC Name: 1,2,3,4-tetrahydroisoquinoline-6,7-diol
Structure
SMILES: OC1=CC2=C(C=C1O)CNCC2
InChI: InChI=1S/C9H11NO2/c11-8-3-6-1-2-10-5-7(6)4-9(8)12/h3-4,10-12H,1-2,5H2
InChIKey: MBFUSGLXKQWVDW-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Xestospongia | Petrosiidae | Haplosclerida | Demospongiae | Porifera | Metazoa | Eukaryota |
| None | Xestospongia | Petrosiidae | Haplosclerida | Demospongiae | Porifera | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 165.19199999999995
TPSA？: 52.49
MolLogP？: 0.7434999999999998
Number of H-Donors: 3
Number of H-Acceptors: 3
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Bos taurus | Phenylethanolamine N-methyltransferase | Ki | 5700.0 | nM | 10.1021/jm00395a006 |
| Bos taurus | Phenylethanolamine N-methyltransferase | Ki | 257039578276886.47 | nM | 10.1016/s0960-894x(99)00022-0 |
| Homo sapiens | Catechol O-methyltransferase | Inhibition | nan | % | 10.1016/j.bmcl.2023.129286 |
| Rattus norvegicus | Adrenergic receptor alpha-2 | Ki | 2089296130854040.8 | nM | 10.1016/s0960-894x(99)00022-0 |
| Rattus norvegicus | GABA-A receptor; anion channel | Ki | 100000.0 | nM | 10.1021/jm00351a015 |
| None | No relevant target | Stability | nan | % | 10.1016/j.bmcl.2023.129286 |