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BioLiP

PDB CCD ID: FBK
Number of entries in BioLiP: 1
Chemical formula: C18 H13 N O3
InChI: InChI=1S/C18H13NO3/c20-15-7-2-5-13(11-15)17-9-3-8-16(19-17)12-4-1-6-14(10-12)18(21)22/h1-11,20H,(H,21,22)
InChIKey: RGVPEEGFSSWQPL-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
CACTVS 3.385Oc1cccc(c1)c2cccc(n2)c3cccc(c3)C(O)=O
OpenEye OEToolkits 2.0.6c1cc(cc(c1)C(=O)O)c2cccc(n2)c3cccc(c3)O
Name:3-[6-(3-hydroxyphenyl)pyridin-2-yl]benzoic acid
Reference:
  • Chengxin Zhang, Xi Zhang, Peter L Freddolino, and Yang Zhang. BioLiP2: an updated structure database for biologically relevent ligand-protein interactions, Nucleic Acids Research, gkad630 (2023)(download the PDF file).
  • 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).

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