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BioLiP

PDB CCD ID: OXC
Number of entries in BioLiP: 3
Chemical formula: C4 H5 N3 O4
InChI: InChI=1S/C4H5N3O4/c8-2(9)1-5-3(10)7-4(11)6-1/h1H,(H,8,9)(H3,5,6,7,10,11)
InChIKey: IRFZLMWJJPULRF-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 1.5.0C1(NC(=O)NC(=O)N1)C(=O)O
CACTVS 3.341OC(=O)C1NC(=O)NC(=O)N1
ACDLabs 10.04O=C1NC(C(=O)O)NC(=O)N1
Name:OXONIC ACID
ZINC: ZINC000001572549
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).
  • 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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