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BioLiP

PDB CCD ID: LBY
Number of entries in BioLiP: 2
Chemical formula: C11 H22 N2 O4
InChI: InChI=1S/C11H22N2O4/c1-11(2,3)17-10(16)13-7-5-4-6-8(12)9(14)15/h8H,4-7,12H2,1-3H3,(H,13,16)(H,14,15)/t8-/m0/s1
InChIKey: VVQIIIAZJXTLRE-QMMMGPOBSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 1.7.6CC(C)(C)OC(=O)NCCCCC(C(=O)O)N
OpenEye OEToolkits 1.7.6CC(C)(C)OC(=O)NCCCC[C@@H](C(=O)O)N
CACTVS 3.370CC(C)(C)OC(=O)NCCCC[CH](N)C(O)=O
ACDLabs 12.01O=C(OC(C)(C)C)NCCCCC(C(=O)O)N
CACTVS 3.370CC(C)(C)OC(=O)NCCCC[C@H](N)C(O)=O
Name:N~6~-(tert-butoxycarbonyl)-L-lysine
ZINC: ZINC000002384792
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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