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BioLiP Library

PDB CCD ID: 8LJ
Number of entries in BioLiP: 0
Chemical formula: C5 H7 N O2
InChI: InChI=1S/C5H7NO2/c7-5(8)4-2-1-3-6-4/h1,3-4,6H,2H2,(H,7,8)/t4-/m0/s1
InChIKey: NXOIMAMHRHDCFR-BYPYZUCNSA-N
SMILES:
SoftwareSMILES
CACTVS 3.385OC(=O)[C@@H]1CC=CN1
OpenEye OEToolkits 2.0.6C1C=CN[C@@H]1C(=O)O
OpenEye OEToolkits 2.0.6C1C=CNC1C(=O)O
ACDLabs 12.01C(=O)(O)C1NC=CC1
CACTVS 3.385OC(=O)[CH]1CC=CN1
Name:(2S)-2,3-dihydro-1H-pyrrole-2-carboxylic 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)(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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