Nicotinaldehyde
AlkaPlorer ID: AK061923
Synonym: None
IUPAC Name: pyridine-3-carbaldehyde
Structure
SMILES: O=CC1=CC=CN=C1
InChI: InChI=1S/C6H5NO/c8-5-6-2-1-3-7-4-6/h1-5H
InChIKey: QJZUKDFHGGYHMC-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Capparis spinosa | Capparis | Capparaceae | Brassicales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 107.11199999999998
TPSA？: 29.96
MolLogP？: 0.8940999999999999
Number of H-Donors: 0
Number of H-Acceptors: 2
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Agaricus bisporus | Tyrosinase | IC50 | 28000.0 | nM | 10.1021/jf200485k |
| Homo sapiens | NAD(+) hydrolase SARM1 | Activity | nan | None | None |
| Homo sapiens | NAD(+) hydrolase SARM1 | Inhibition | nan | % | None |
| Meloidogyne incognita | Meloidogyne incognita | EC50 | 10.0 | ug.mL-1 | 10.1021/jf302075w |
| Meloidogyne incognita | Meloidogyne incognita | EC50 | 250.0 | ug.mL-1 | 10.1021/jf302075w |
| Mus musculus | GABA transporter 1 | Activity | 57.0 | % | 10.1016/j.bmc.2019.05.001 |
| Mus musculus | GABA transporter 1 | Activity | 94.0 | % | 10.1016/j.bmc.2019.02.015 |
| Oryctolagus cuniculus | Aldehyde oxidase | IC50 | 600000.0 | nM | 10.1021/jf200485k |
| Oryctolagus cuniculus | Aldehyde oxidase | Inhibition | 5.0 | % | 10.1021/jf200485k |
| Rattus norvegicus | GABA-A receptor; anion channel | Ki | 100000.0 | nM | 10.1021/jm00351a015 |
| Staphylococcus aureus | Quinolone resistance protein norA | Activity | 128.0 | ug ml-1 | 10.1021/jm401808n |
| Staphylococcus aureus | Staphylococcus aureus | MIC | 64.0 | ug.mL-1 | 10.1021/jm401808n |
| Staphylococcus aureus | Staphylococcus aureus | MIC | 128.0 | ug.mL-1 | 10.1021/jm401808n |
| None | Unchecked | IC50 | 54000.0 | nM | 10.1016/j.ejmech.2015.10.014 |
| None | Unchecked | IC50 | 1000000.0 | nM | 10.1021/jf200485k |
| None | Unchecked | Inhibition | 16.0 | % | 10.1016/j.ejmech.2015.10.014 |
| None | Unchecked | Inhibition | 17.0 | % | 10.1021/jf200485k |
| None | Unchecked | Inhibition | nan | % | 10.1016/j.ejmech.2015.10.014 |