Quinoline-3-carboxylic acid
AlkaPlorer ID: AK002349
Synonym: None
IUPAC Name: quinoline-3-carboxylic acid
Structure
SMILES: C1=CC=C2C(=C1)C=C(C=N2)C(=O)O
InChI: InChI=1S/C10H7NO2/c12-10(13)8-5-7-3-1-2-4-9(7)11-6-8/h1-6H,(H,12,13)
InChIKey: DJXNJVFEFSWHLY-UHFFFAOYSA-N
Reference
Anti-inflammatory quinoline alkaloids from the root bark of Dictamnus dasycarpus
PubChem CID: 80971
CAS: 118803-81-9
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Dictamnus dasycarpus | Dictamnus | Rutaceae | Sapindales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 173.17099999999996
TPSA？: 50.19
MolLogP？: 1.9329999999999996
Number of H-Donors: 1
Number of H-Acceptors: 2
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Human immunodeficiency virus 1 | Human immunodeficiency virus type 1 reverse transcriptase | IC50 | 2400000.0 | nM | 10.1016/j.bmcl.2018.12.027 |
| Oryctolagus cuniculus | Glycogen phosphorylase, muscle form | Activity | nan | None | 10.1021/acs.jmedchem.5b01114 |
| Rattus norvegicus | GABA-A receptor; anion channel | Ki | 100000.0 | nM | 10.1021/jm00351a015 |
| Rattus norvegicus | Rattus norvegicus | MED | 50.0 | mg kg-1 | 10.1021/jm00193a013 |
| Rattus norvegicus | Rattus norvegicus | MED | 150.0 | mg kg-1 | 10.1021/jm00193a013 |
| Saccharomyces cerevisiae S288c | Histone acetyltransferase GCN5 | Activity | nan | None | 10.1021/jm060601m |
| Staphylococcus aureus | Quinolone resistance protein norA | Activity | 32.0 | 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 |