SEQ2FUN

BioLiP

PDB CCD ID: 8HQ
Number of entries in BioLiP: 2
Chemical formula: C10 H7 N O3
InChI: InChI=1S/C10H7NO3/c12-8-3-1-2-6-7(10(13)14)4-5-11-9(6)8/h1-5,12H,(H,13,14)
InChIKey: KPTUKANGPPVLMD-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
CACTVS 3.385OC(=O)c1ccnc2c(O)cccc12
ACDLabs 12.01O=C(O)c1c2cccc(O)c2ncc1
OpenEye OEToolkits 1.9.2c1cc2c(ccnc2c(c1)O)C(=O)O
Name:8-hydroxyquinoline-4-carboxylic acid
ChEMBL: CHEMBL1435274
ZINC: ZINC000001710266
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).