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BioLiP Library

PDB CCD ID: A1ANH
Number of entries in BioLiP: 1
Chemical formula: C4 H2 N2 O
InChI: InChI=1S/C4H2N2O/c5-1-4-2-7-3-6-4/h2-3H
InChIKey: UEEBKQWDBWDPKD-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 2.0.7c1c(nco1)C#N
ACDLabs 12.01
CACTVS 3.385		N#Cc1cocn1
Name:1,3-oxazole-4-carbonitrile
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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