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BioLiP

PDB CCD ID: G6C
Number of entries in BioLiP: 4
Chemical formula: C5 H5 N O2
InChI: InChI=1S/C5H5NO2/c7-4-1-2-5(8)6-3-4/h1-3,7H,(H,6,8)
InChIKey: CHGPEDOMXOLANF-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 2.0.7C1=CC(=O)NC=C1O
CACTVS 3.385OC1=CNC(=O)C=C1
Name:5-oxidanyl-1H-pyridin-2-one
ZINC: ZINC000013527001
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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