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BioLiP Library

PDB CCD ID: 8SG
Number of entries in BioLiP: 1
Chemical formula: C9 H8 N2 O3
InChI: InChI=1S/C9H8N2O3/c1-6-5-8(14-11-6)10-9(12)7-3-2-4-13-7/h2-5H,1H3,(H,10,12)
InChIKey: DXEANZHOQJCTFV-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 2.0.6Cc1cc(on1)NC(=O)c2ccco2
CACTVS 3.385Cc1cc(NC(=O)c2occc2)on1
ACDLabs 12.01N(C(=O)c1ccco1)c2cc(C)no2
Name:N-(3-methyl-1,2-oxazol-5-yl)furan-2-carboxamide
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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