SEQ2FUN

BioLiP

PDB CCD ID: 8IG
Number of entries in BioLiP: 3
Chemical formula: C5 H4 I N5 O
InChI: InChI=1S/C5H4IN5O/c6-4-8-1-2(9-4)10-5(7)11-3(1)12/h(H4,7,8,9,10,11,12)
InChIKey: SXGFECRAKVVEJT-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 1.5.0c12c([nH]c(n1)I)N=C(NC2=O)N
ACDLabs 10.04Ic2nc1c(N=C(NC1=O)N)n2
CACTVS 3.341NC1=Nc2[nH]c(I)nc2C(=O)N1
Name:8-IODO-GUANINE
DrugBank: DB02985
ZINC: ZINC000004878369
Reference:
  • Chengxin Zhang, Xi Zhang, Lydia 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).