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BioLiP

PDB CCD ID: PVO
Number of entries in BioLiP: 3
Chemical formula: C3 H6 O4
InChI: InChI=1S/C3H6O4/c1-3(6,7)2(4)5/h6-7H,1H3,(H,4,5)
InChIKey: HPQUMJNDQVOTAZ-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
CACTVS 3.385CC(O)(O)C(O)=O
OpenEye OEToolkits 2.0.5CC(C(=O)O)(O)O
Name:2,2-bis(oxidanyl)propanoic acid
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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