UNPD169013
AlkaPlorer ID: AK319289
Synonym: None
IUPAC Name: (5Z,8Z,11Z)-N-[2-(4-hydroxyphenyl)ethyl]tetradeca-5,8,11-trienamide
Structure
SMILES: CC/C=C\C/C=C\C/C=C\CCCC(O)=NCCC1=CC=C(O)C=C1
InChI: InChI=1S/C22H31NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-22(25)23-19-18-20-14-16-21(24)17-15-20/h3-4,6-7,9-10,14-17,24H,2,5,8,11-13,18-19H2,1H3,(H,23,25)/b4-3-,7-6-,10-9-
InChIKey: XAMOJFHBVRVLCL-PDBXOOCHSA-N
Reference
Antiplasmodial Metabolites Isolated from the Marine Octocoral <i>Muricea austera</i>
PubChem CID: 16091485
LOTUS: LTS0046364
SuperNatural Ⅲ: SN0424924-01
NPASS: NPC231705
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Muricea austera | Muricea | Plexauridae | Malacalcyonacea | Anthozoa | Cnidaria | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 341.495
TPSA？: 52.82000000000001
MolLogP？: 5.920300000000006
Number of H-Donors: 2
Number of H-Acceptors: 2
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Plasmodium falciparum | Plasmodium falciparum | IC50 | 38000.0 | nM | 10.1021/np060007f |
| Trypanosoma cruzi | Trypanosoma cruzi | IC50 | nan | None | 10.1021/np060007f |