(2E,4E,10E)-N-(2-methylpropyl)dodeca-2,4,8,10-tetraenamide
AlkaPlorer ID: AK548686
Synonym: None
IUPAC Name: (2E,4E,8E,10Z)-N-(2-methylpropyl)dodeca-2,4,8,10-tetraenamide
Structure
SMILES: C/C=C\C=C\CC/C=C/C=C/C(O)=NCC(C)C
InChI: InChI=1S/C16H25NO/c1-4-5-6-7-8-9-10-11-12-13-16(18)17-14-15(2)3/h4-7,10-13,15H,8-9,14H2,1-3H3,(H,17,18)/b5-4-,7-6+,11-10+,13-12+
InChIKey: VLGRWXYRKYWRPX-ACCGBCAYSA-N
Reference
Neue acetylenverbindungen aus Leucanthemum-arten und revision der struktur eines germacranolids
PubChem CID: 12315250
LOTUS: LTS0242730
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Acmella caulirhiza | Acmella | Asteraceae | Asterales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 247.382
TPSA？: 32.59
MolLogP？: 4.623800000000004
Number of H-Donors: 1
Number of H-Acceptors: 1
RingCount: 0
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Homo sapiens | Cannabinoid CB2 receptor | Ki | 4535.0 | nM | 10.1021/acs.jnatprod.8b00874 |