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BioLiP

PDB CCD ID: 7FN
Number of entries in BioLiP: 11
Chemical formula: C6 H4 O5
InChI: InChI=1S/C6H4O5/c7-5(8)3-1-2-4(11-3)6(9)10/h1-2H,(H,7,8)(H,9,10)
InChIKey: CHTHALBTIRVDBM-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 2.0.6c1cc(oc1C(=O)O)C(=O)O
CACTVS 3.385OC(=O)c1oc(cc1)C(O)=O
ACDLabs 12.01OC(=O)c1ccc(o1)C(O)=O
Name:2,5 Furan Dicarboxylic Acid
ZINC: ZINC000001672226
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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