Cocculine; N-Me
AlkaPlorer ID: AK292729
Synonym: Pachygonine
IUPAC Name: 2-methoxy-7-methyl-2,3,5,6,8,9-hexahydro-1H-indolo[7a,1-a]isoquinolin-7-ium-12-ol
Structure
SMILES: COC1CC=C2CC[N+]3(C)CCC4=CC=C(O)C=C4C23C1
InChI: InChI=1S/C18H23NO2/c1-19-9-7-13-3-5-15(20)11-17(13)18(19)12-16(21-2)6-4-14(18)8-10-19/h3-5,11,16H,6-10,12H2,1-2H3/p+1
InChIKey: ZZOIDXABHPNSHY-UHFFFAOYSA-O
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Pachygone ovata | Pachygone | Menispermaceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 286.3950000000001
TPSA？: 29.46
MolLogP？: 2.7291000000000007
Number of H-Donors: 1
Number of H-Acceptors: 2
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|