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BioLiP

PDB CCD ID: OXG
Number of entries in BioLiP: 9
Chemical formula: C5 H3 N5 O2
InChI: InChI=1S/C5H3N5O2/c6-4-8-2-1(3(11)10-4)7-5(12)9-2/h(H3,6,8,9,10,11,12)
InChIKey: UBKVUFQGVWHZIR-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
CACTVS 3.341NC1=NC2=NC(=O)N=C2C(=O)N1
ACDLabs 10.04O=C1C2=NC(=O)N=C2N=C(N1)N
OpenEye OEToolkits 1.5.0C12=NC(=O)N=C1N=C(NC2=O)N
Name:8-OXOGUANINE
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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