UNPD102845
AlkaPlorer ID: AK319901
Synonym: None
IUPAC Name: (2E,4E,8Z)-N-(2-methylpropyl)deca-2,4,8-trienamide
Structure
SMILES: C/C=C\CC/C=C/C=C/C(O)=NCC(C)C
InChI: InChI=1S/C14H23NO/c1-4-5-6-7-8-9-10-11-14(16)15-12-13(2)3/h4-5,8-11,13H,6-7,12H2,1-3H3,(H,15,16)/b5-4-,9-8+,11-10+
InChIKey: OCUXKVCDBHKIIP-QYHQRLDKSA-N
Reference
Polyenoic acid piperideides and other alkamides from Achillea millefolium
PubChem CID: 14427412
LOTUS: LTS0266611
SuperNatural Ⅲ: SN0261939-03
NPASS: NPC307435
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Alstonia vitiensis | Alstonia | Apocynaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Asarum sieboldii | Asarum | Asaraceae | Piperales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 221.344
TPSA？: 32.59
MolLogP？: 4.067600000000003
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 | HepG2 | Activity | nan | None | 10.1016/j.bmcl.2012.01.136 |
| Homo sapiens | Peroxisome proliferator-activated receptor alpha | Activity | nan | None | 10.1016/j.bmcl.2012.01.136 |
| Homo sapiens | Peroxisome proliferator-activated receptor alpha | EC50 | 4000.0 | nM | 10.1016/j.bmcl.2012.01.136 |
| Homo sapiens | Peroxisome proliferator-activated receptor delta | EC50 | 4900.0 | nM | 10.1016/j.bmcl.2012.01.136 |
| Homo sapiens | Peroxisome proliferator-activated receptor gamma | EC50 | 3600.0 | nM | 10.1016/j.bmcl.2012.01.136 |
| None | Unchecked | Activity | nan | None | 10.1016/j.bmcl.2012.01.136 |
| None | Unchecked | EC50 | 2000.0 | nM | 10.1016/j.bmcl.2012.01.136 |