SEQ2FUN

BioLiP

PDB CCD ID: GJP
Number of entries in BioLiP: 4
Chemical formula: C10 H7 N O3
InChI: InChI=1S/C10H7NO3/c12-9-6-3-1-2-4-8(6)11-5-7(9)10(13)14/h1-5H,(H,11,12)(H,13,14)
InChIKey: ILNJBIQQAIIMEY-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
ACDLabs 12.01c12ccccc1c(c(cn2)C(O)=O)O
OpenEye OEToolkits 2.0.6c1ccc2c(c1)c(c(cn2)C(=O)O)O
CACTVS 3.385OC(=O)c1cnc2ccccc2c1O
Name:4-hydroxyquinoline-3-carboxylic acid
ChEMBL: CHEMBL158890
ZINC: ZINC000008602789
Reference:
  • Chengxin Zhang, Xi Zhang, Lydia Freddolino, and Yang Zhang. BioLiP2: an updated structure database for biologically relevent ligand-protein interactions, Nucleic Acids Research, gkad630 (2023).
  • Jianyi Yang, Ambrish Roy, and Yang Zhang. BioLiP: a semi-manually curated database for biologically relevant ligand-protein interactions, Nucleic Acids Research, 41: D1096-D1103 (2013) (download the PDF file).