BioLiP

PDB

BioLiP

PDB CCD ID:

ELY

Number of entries in BioLiP:

Chemical formula:

C10 H22 N2 O2

InChI:

InChI=1S/C10H22N2O2/c1-3-12(4-2)8-6-5-7-9(11)10(13)14/h9H,3-8,11H2,1-2H3,(H,13,14)/t9-/m0/s1

InChIKey:

LBVIZDDNHRTLPY-VIFPVBQESA-N

SMILES:

Software	SMILES
OpenEye OEToolkits 2.0.7	CCN(CC)CCCCC(C(=O)O)N
CACTVS 3.385	CCN(CC)CCCC[CH](N)C(O)=O
ACDLabs 12.01	C(=O)(C(N)CCCCN(CC)CC)O
OpenEye OEToolkits 2.0.7	CCN(CC)CCCC[C@@H](C(=O)O)N
CACTVS 3.385	CCN(CC)CCCC[C@H](N)C(O)=O

Name:

N~6~,N~6~-diethyl-L-lysine;
(2S)-2-azanyl-6-(diethylamino)hexanoic acid

ZINC:

ZINC000066166863

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).