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BioLiP

PDB CCD ID: EN4
Number of entries in BioLiP: 4
Chemical formula: C7 H11 N O4
InChI: InChI=1S/C7H11NO4/c9-6(7(10)11)8(12)5-3-1-2-4-5/h5,12H,1-4H2,(H,10,11)
InChIKey: LBAXJZMLDPZSOL-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 2.0.6C1CCC(C1)N(C(=O)C(=O)O)O
CACTVS 3.385ON(C1CCCC1)C(=O)C(O)=O
ACDLabs 12.01C(C(=O)N(C1CCCC1)O)(O)=O
Name:[cyclopentyl(hydroxy)amino](oxo)acetic acid
ChEMBL: CHEMBL4750325
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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