SEQ2FUN

BioLiP

PDB CCD ID: 70W
Number of entries in BioLiP: 1
Chemical formula: C10 H20 N2 O2
InChI: InChI=1S/C10H20N2O2/c1-10(2,3)14-9(13)12-6-4-8(11)5-7-12/h8H,4-7,11H2,1-3H3
InChIKey: LZRDHSFPLUWYAX-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
CACTVS 3.385CC(C)(C)OC(=O)N1CCC(N)CC1
ACDLabs 12.01C(C)(C)(C)OC(N1CCC(N)CC1)=O
OpenEye OEToolkits 2.0.5CC(C)(C)OC(=O)N1CCC(CC1)N
Name:tert-butyl 4-aminopiperidine-1-carboxylate
ChEMBL: CHEMBL3904068
ZINC: ZINC000004202304
Reference:
  • Chengxin Zhang, Xi Zhang, Lydia 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).