canadaline
AlkaPlorer ID: AK038196
Synonym: 'Canadaline', 'R(-)-canadaline', '2,3-dimethoxy-6-(5R)-6-methyl-7,8-dihydro-5H-1,3dioxolo4,5-gisoquinolin-5-ylmethylbenzaldehyde', '(+)-Canadaline', '(-)-canadaline(R)'
IUPAC Name: 2,3-dimethoxy-6-[[(5S)-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-5-yl]methyl]benzaldehyde
Structure
SMILES: COC1=CC=C(C[C@H]2C3=CC4=C(C=C3CCN2C)OCO4)C(C=O)=C1OC
InChI: InChI=1S/C21H23NO5/c1-22-7-6-14-9-19-20(27-12-26-19)10-15(14)17(22)8-13-4-5-18(24-2)21(25-3)16(13)11-23/h4-5,9-11,17H,6-8,12H2,1-3H3/t17-/m0/s1
InChIKey: ROAHDZJDHGLGBA-KRWDZBQOSA-N
Reference
Antibacterial Activity of <i>Hydrastis canadensis</i> Extract and its Major Isolated Alkaloids
PubChem CID: 14527257
LOTUS: LTS0040209
SuperNatural Ⅲ: SN0330602-01
NPASS: NPC47017
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Imperata cylindrica | Imperata | Poaceae | Poales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 369.41700000000014
TPSA？: 57.23
MolLogP？: 3.016700000000001
Number of H-Donors: 0
Number of H-Acceptors: 6
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|