SEQ2FUN

BioLiP

PDB CCD ID: 9UU
Number of entries in BioLiP: 1
Chemical formula: C10 H7 N O3
InChI: InChI=1S/C10H7NO3/c12-8-3-1-7(2-4-8)11-9(13)5-6-10(11)14/h1-6,12H
InChIKey: BLLFPKZTBLMEFG-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
CACTVS 3.385Oc1ccc(cc1)N2C(=O)C=CC2=O
OpenEye OEToolkits 2.0.7c1cc(ccc1N2C(=O)C=CC2=O)O
Name:1-(4-hydroxyphenyl)pyrrole-2,5-dione
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).