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BioLiP

PDB CCD ID: QHO
Number of entries in BioLiP: 2
Chemical formula: C7 H4 F3 N O2
InChI: InChI=1S/C7H4F3NO2/c8-3-1-4(7(12)11-13)6(10)5(9)2-3/h1-2,13H,(H,11,12)
InChIKey: KNGFWHCRGOZPON-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 2.0.7c1c(cc(c(c1C(=O)NO)F)F)F
ACDLabs 12.01Fc1c(cc(F)cc1F)C(=O)NO
CACTVS 3.385ONC(=O)c1cc(F)cc(F)c1F
Name:2,3,5-trifluoro-N-hydroxybenzamide
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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