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BioLiP

PDB CCD ID: PYM
Number of entries in BioLiP: 2
Chemical formula: C3 H5 N O2
InChI: InChI=1S/C3H5NO2/c1-2(5)3(4)6/h1H3,(H2,4,6)
InChIKey: FPOLWERNILTNDK-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
ACDLabs 10.04O=C(C(=O)N)C
CACTVS 3.341CC(=O)C(N)=O
OpenEye OEToolkits 1.5.0CC(=O)C(=O)N
Name:PYRUVAMIDE
DrugBank: DB03578
ZINC: ZINC000001581119
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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