tetrahydropalmatine
AlkaPlorer ID: AK001766
Synonym: '', '2,3,9,10-Tetramethoxy-5,8,13,13a-tetrahydro-6H-isoquino3,2-aisoquinoline', 'L-tetrahydropalmatine', 'MLS000029596', 'Tetrahydropalmatine', 'Rotundine', '(+/-)-Tetrahydropalmatine', '2,3,9,10-tetramethoxy-13aalpha-berbine', '(S)-Tetrahydropalmatine', 'SMR000008833', '(-)-Tetrahydropalmatine', 'dl-Tetrahydropalmatine', 'MLSMR', 'Corydalis B', '(-)-Rotundine(Stephania)', 'MLS002535962', 'tetrahydropalmatine', '2,3,9,10-Tetramethoxyberbine', '(-)-tetrahydropalmatine', '(S)-tetrahydropalmatine', 'TETRAHYDROPALMATINE', '(+)-Tetrahydropalmatine', '2934-97-6', '(S)-(-)-tetrahydropalmatine', 'l-Tetrahydropalmatine'
IUPAC Name: (13aR)-2,3,9,10-tetramethoxy-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinoline
Structure
SMILES: COC1=CC2=C(C=C1OC)[C@H]1CC3=C(CN1CC2)C(OC)=C(OC)C=C3
InChI: InChI=1S/C21H25NO4/c1-23-18-6-5-13-9-17-15-11-20(25-3)19(24-2)10-14(15)7-8-22(17)12-16(13)21(18)26-4/h5-6,10-11,17H,7-9,12H2,1-4H3/t17-/m1/s1
InChIKey: AEQDJSLRWYMAQI-QGZVFWFLSA-N
Reference
PubChem CID: 969488
CAS: 3520-14-7
LOTUS: LTS0175021
SuperNatural Ⅲ: SN0003583-02
NPASS: NPC106295
Source
Properties Information
Molecule Weight: 355.434
TPSA?: 40.16
MolLogP?: 3.376500000000002
Number of H-Donors: 0
Number of H-Acceptors: 5
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Homo sapiens | Dopamine D1 receptor | Inhibition | 39.8 | % | 10.1016/j.bmc.2012.12.016 |
| Homo sapiens | Dopamine D1 receptor | Ki | nan | None | 10.1016/j.bmc.2012.12.016 |
| Homo sapiens | Dopamine D2 receptor | Inhibition | 20.5 | % | 10.1016/j.bmc.2012.12.016 |
| Homo sapiens | Dopamine D2 receptor | Ki | nan | None | 10.1016/j.bmc.2012.12.016 |
| Homo sapiens | Serotonin 1a (5-HT1a) receptor | Inhibition | 30.4 | % | 10.1016/j.bmc.2012.12.016 |
| Homo sapiens | Serotonin 1a (5-HT1a) receptor | Ki | nan | None | 10.1016/j.bmc.2012.12.016 |
| Homo sapiens | Serotonin 2a (5-HT2a) receptor | Inhibition | 29.7 | % | 10.1016/j.bmc.2012.12.016 |
| Homo sapiens | Serotonin 2a (5-HT2a) receptor | Ki | nan | None | 10.1016/j.bmc.2012.12.016 |
