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BioLiP

PDB CCD ID: 6Y9
Number of entries in BioLiP: 0
Chemical formula: C7 H13 N O2
InChI: InChI=1S/C7H13NO2/c1-7(6(9)10)4-3-5-8(7)2/h3-5H2,1-2H3,(H,9,10)/t7-/m1/s1
InChIKey: BWNGEDLBTNTBMD-SSDOTTSWSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 2.0.5CC1(CCCN1C)C(=O)O
OpenEye OEToolkits 2.0.5C[C@@]1(CCCN1C)C(=O)O
CACTVS 3.385CN1CCC[C]1(C)C(O)=O
CACTVS 3.385CN1CCC[C@]1(C)C(O)=O
Name:(2~{R})-1,2-dimethylpyrrolidine-2-carboxylic acid
ZINC: ZINC000066351392
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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