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BioLiP

PDB CCD ID: G8X
Number of entries in BioLiP: 4
Chemical formula: C5 H9 N O3
InChI: InChI=1S/C5H9NO3/c7-3-1-2-6-4(3)5(8)9/h3-4,6-7H,1-2H2,(H,8,9)/t3-,4+/m1/s1
InChIKey: BJBUEDPLEOHJGE-DMTCNVIQSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 2.0.7C1CNC(C1O)C(=O)O
CACTVS 3.385O[CH]1CCN[CH]1C(O)=O
OpenEye OEToolkits 2.0.7C1CN[C@@H]([C@@H]1O)C(=O)O
CACTVS 3.385O[C@@H]1CCN[C@@H]1C(O)=O
Name:(2~{S},3~{R})-3-oxidanylpyrrolidine-2-carboxylic acid
ZINC: ZINC000004521590
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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