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BioLiP

PDB CCD ID: CNG
Number of entries in BioLiP: 0
Chemical formula: C10 H19 N O2
InChI: InChI=1S/C10H19NO2/c12-10(13)8-11-9-6-4-2-1-3-5-7-9/h9,11H,1-8H2,(H,12,13)
InChIKey: PNKNDNFLQNMQJL-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
CACTVS 3.370OC(=O)CNC1CCCCCCC1
OpenEye OEToolkits 1.7.6C1CCCC(CCC1)NCC(=O)O
ACDLabs 12.01O=C(O)CNC1CCCCCCC1
Name:N-cyclooctylglycine
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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