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BioLiP

PDB CCD ID: FOA
Number of entries in BioLiP: 13
Chemical formula: C5 H4 O3
InChI: InChI=1S/C5H4O3/c6-5(7)4-2-1-3-8-4/h1-3H,(H,6,7)
InChIKey: SMNDYUVBFMFKNZ-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
ACDLabs 10.04O=C(O)c1occc1
OpenEye OEToolkits 1.5.0c1cc(oc1)C(=O)O
CACTVS 3.341OC(=O)c1occc1
Name:2-FUROIC ACID
ChEMBL: CHEMBL1232797
ZINC: ZINC000000158555
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)(download the PDF file).
  • 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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