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BioLiP

PDB CCD ID: LCK
Number of entries in BioLiP: 0
Chemical formula: C10 H18 N2 O4
InChI: InChI=1S/C10H18N2O4/c1-7(6-9(13)14)12-5-3-2-4-8(11)10(15)16/h8H,2-6,11H2,1H3,(H,13,14)(H,15,16)/b12-7-/t8-/m0/s1
InChIKey: PCARXDDZXPRYII-VQLBTBKJSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 1.5.0C/C(=N/CCCC[C@@H](C(=O)O)N)/CC(=O)O
CACTVS 3.341CC(CC(O)=O)=NCCCC[C@H](N)C(O)=O
ACDLabs 10.04O=C(O)CC(=N/CCCCC(N)C(=O)O)\C
OpenEye OEToolkits 1.5.0CC(=NCCCCC(C(=O)O)N)CC(=O)O
CACTVS 3.341CC(CC(O)=O)=NCCCC[CH](N)C(O)=O
Name:(Z)-N~6~-(2-carboxy-1-methylethylidene)-L-lysine
ZINC: ZINC000058639106
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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