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BioLiP Library

PDB CCD ID: 6FL
Number of entries in BioLiP: 0
Chemical formula: C6 H7 F6 N O2
InChI: InChI=1S/C6H7F6NO2/c7-5(8,9)3(6(10,11)12)1-2(13)4(14)15/h2-3H,1,13H2,(H,14,15)/t2-/m0/s1
InChIKey: MNZLMQYCEWHPPS-REOHCLBHSA-N
SMILES:
SoftwareSMILES
ACDLabs 12.01FC(F)(F)C(CC(N)C(=O)O)C(F)(F)F
OpenEye OEToolkits 1.7.2C([C@@H](C(=O)O)N)C(C(F)(F)F)C(F)(F)F
CACTVS 3.370N[CH](CC(C(F)(F)F)C(F)(F)F)C(O)=O
CACTVS 3.370N[C@@H](CC(C(F)(F)F)C(F)(F)F)C(O)=O
OpenEye OEToolkits 1.7.2C(C(C(=O)O)N)C(C(F)(F)F)C(F)(F)F
Name:5,5,5,5',5',5'-hexafluoro-L-leucine
ZINC: ZINC000002560328
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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