Isoscoulerine; (S)-form, N-Me(cis-)
AlkaPlorer ID: AK303020
Synonym: Steponine
IUPAC Name: 2,10-dimethoxy-7-methyl-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinolin-7-ium-3,9-diol
Structure
SMILES: COC1=C(O)C=C2CC[N+]3(C)CC4=C(O)C(OC)=CC=C4CC3C2=C1
InChI: InChI=1S/C20H23NO4/c1-21-7-6-13-9-17(22)19(25-3)10-14(13)16(21)8-12-4-5-18(24-2)20(23)15(12)11-21/h4-5,9-10,16H,6-8,11H2,1-3H3,(H-,22,23)/p+1
InChIKey: JPZIEDNXIGBQCY-UHFFFAOYSA-O
Source
Properties Information
Molecule Weight: 342.415
TPSA？: 58.92
MolLogP？: 2.9151000000000016
Number of H-Donors: 2
Number of H-Acceptors: 4
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|