Grenadamide
AlkaPlorer ID: AK321994
Synonym: None
IUPAC Name: (5E)-N-[(E)-10-chloro-4,6-dimethyl-5-oxodec-9-en-2-yl]-5-(chloromethylidene)octanamide
Structure
SMILES: CCC/C(=C\Cl)CCCC(=O)NC(C)CC(C)C(=O)C(C)CC/C=C/Cl
InChI: InChI=1S/C21H35Cl2NO2/c1-5-9-19(15-23)11-8-12-20(25)24-18(4)14-17(3)21(26)16(2)10-6-7-13-22/h7,13,15-18H,5-6,8-12,14H2,1-4H3,(H,24,25)/b13-7+,19-15+
InChIKey: OEEXJHFQVSGEBK-KFPQZNHNSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Lyngbya majuscula | Lyngbya | Oscillatoriaceae | Oscillatoriales | Cyanophyceae | Cyanobacteriota | None | Bacteria |
Properties Information
Molecule Weight: 404.42200000000014
TPSA？: 46.17
MolLogP？: 6.348300000000006
Number of H-Donors: 1
Number of H-Acceptors: 2
RingCount: 0
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Homo sapiens | HEK293 | IC50 | 100000.0 | nM | 10.1021/np900173d |
| Spodoptera exigua | Spodoptera exigua | Activity | 50.0 | % | 10.1021/np900173d |