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BioLiP Library

PDB CCD ID: YIZ
Number of entries in BioLiP: 1
Chemical formula: C10 H12 N2 O3
InChI: InChI=1S/C10H12N2O3/c1-7(13)11-6-8-2-4-9(5-3-8)10(14)12-15/h2-5,15H,6H2,1H3,(H,11,13)(H,12,14)
InChIKey: DWOKCNQEXSKNLD-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
ACDLabs 12.01ONC(=O)c1ccc(CNC(C)=O)cc1
CACTVS 3.385
OpenEye OEToolkits 2.0.7		CC(=O)NCc1ccc(cc1)C(=O)NO
Name:4-(acetamidomethyl)-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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