SEQ2FUN

BioLiP

PDB CCD ID: OV9
Number of entries in BioLiP: 0
Chemical formula: C7 H5 N5 O3
InChI: InChI=1S/C7H5N5O3/c8-7-11-4-3(5(13)12-7)9-1-2(10-4)6(14)15/h1H,(H,14,15)(H3,8,10,11,12,13)
InChIKey: NZLJLZVXWBEGCE-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 2.0.7c1c(nc2c(n1)C(=O)NC(=N2)N)C(=O)O
CACTVS 3.385NC1=Nc2nc(cnc2C(=O)N1)C(O)=O
Name:2-azanyl-4-oxidanylidene-3~{H}-pteridine-7-carboxylic acid
ChEMBL: CHEMBL1738820
ZINC: ZINC000006090930
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).