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BioLiP

PDB CCD ID: PXC
Number of entries in BioLiP: 2
Chemical formula: C14 H8 N2 O4
InChI: InChI=1S/C14H8N2O4/c17-13(18)7-3-1-5-9-11(7)16-10-6-2-4-8(14(19)20)12(10)15-9/h1-6H,(H,17,18)(H,19,20)
InChIKey: MJALVONLCNWZHK-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 1.7.0c1cc(c2c(c1)nc3c(cccc3n2)C(=O)O)C(=O)O
CACTVS 3.352OC(=O)c1cccc2nc3c(cccc3C(O)=O)nc12
Name:phenazine-1,6-dicarboxylic acid
ChEMBL: CHEMBL1235512
ZINC: ZINC000004102350
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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