None
AlkaPlorer ID: AK324825
Synonym: None
IUPAC Name: 17-hydroxyoctadeca-6,8,10-triynedinitrile
Structure
SMILES: N#CCCCCC#CC#CC#CCCCCCC(O)C#N
InChI: InChI=1S/C18H20N2O/c19-16-14-12-10-8-6-4-2-1-3-5-7-9-11-13-15-18(21)17-20/h18,21H,7-15H2
InChIKey: DASCGFNZWHVXCU-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Mycale sp. | Mycale | Mycalidae | Poecilosclerida | Demospongiae | Porifera | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 280.3709999999999
TPSA？: 67.81
MolLogP？: 2.915560000000001
Number of H-Donors: 1
Number of H-Acceptors: 3
RingCount: 0
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Bacillus spizizenii | Bacillus spizizenii | MIC | 90000.0 | nM | 10.1021/acs.jnatprod.9b00840 |
| Candida albicans | Candida albicans | MIC | 360000.0 | nM | 10.1021/acs.jnatprod.9b00840 |
| Escherichia coli | Escherichia coli | MIC | 360000.0 | nM | 10.1021/acs.jnatprod.9b00840 |
| Giardia intestinalis | Giardia intestinalis | MIC | 90000.0 | nM | 10.1021/acs.jnatprod.9b00840 |
| Homo sapiens | NFF | MIC | 90000.0 | nM | 10.1021/acs.jnatprod.9b00840 |
| Tritrichomonas foetus | Tritrichomonas foetus | MIC | 360000.0 | nM | 10.1021/acs.jnatprod.9b00840 |
| None | Unchecked | MIC | 180000.0 | nM | 10.1021/acs.jnatprod.9b00840 |