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BioLiP

PDB CCD ID: LFK
Number of entries in BioLiP: 2
Chemical formula: C14 H10 O5
InChI: InChI=1S/C14H10O5/c15-11-5-1-4-10(7-11)14(18)19-12-6-2-3-9(8-12)13(16)17/h1-8,15H,(H,16,17)
InChIKey: IZVHEBMVWHVUFW-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 2.0.7c1cc(cc(c1)O)C(=O)Oc2cccc(c2)C(=O)O
CACTVS 3.385OC(=O)c1cccc(OC(=O)c2cccc(O)c2)c1
Name:3-(3-hydroxyphenyl)carbonyloxybenzoic 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).
  • 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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