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BioLiP

PDB CCD ID: QI5
Number of entries in BioLiP: 2
Chemical formula: C7 H2 F5 N O2
InChI: InChI=1S/C7H2F5NO2/c8-2-1(7(14)13-15)3(9)5(11)6(12)4(2)10/h15H,(H,13,14)
InChIKey: MANBOMDQSILBJG-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 2.0.7c1(c(c(c(c(c1F)F)F)F)F)C(=O)NO
CACTVS 3.385ONC(=O)c1c(F)c(F)c(F)c(F)c1F
ACDLabs 12.01Fc1c(c(F)c(F)c(F)c1F)C(=O)NO
Name:2,3,4,5,6-pentafluoro-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)(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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