2-[6-(2H-1,3-benzodioxol-5-yl)hexyl]-4-methoxyquinoline
AlkaPlorer ID: AK160209
Synonym: None
IUPAC Name: 2-[6-(1,3-benzodioxol-5-yl)hexyl]-4-methoxyquinoline
Structure
SMILES: COC1=CC(CCCCCCC2=CC=C3OCOC3=C2)=NC2=CC=CC=C12
InChI: InChI=1S/C23H25NO3/c1-25-22-15-18(24-20-11-7-6-10-19(20)22)9-5-3-2-4-8-17-12-13-21-23(14-17)27-16-26-21/h6-7,10-15H,2-5,8-9,16H2,1H3
InChIKey: XJXAZXGARODQBO-UHFFFAOYSA-N
Reference
New Quinoline Alkaloids from <i>Ruta chalepensis</i>
PubChem CID: 9998809
LOTUS: LTS0091029
SuperNatural Ⅲ: SN0432207
COCONUT: CNP0173510
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Ruta chalepensis | Ruta | Rutaceae | Sapindales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 363.4570000000001
TPSA？: 40.58
MolLogP？: 5.317700000000005
Number of H-Donors: 0
Number of H-Acceptors: 4
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|