BioLiP

PDB

BioLiP

PDB CCD ID:

DLS

Number of entries in BioLiP:

Chemical formula:

C10 H18 N2 O4

InChI:

InChI=1S/C10H18N2O4/c1-7(13)11-6-4-3-5-9(10(15)16)12-8(2)14/h9H,3-6H2,1-2H3,(H,11,13)(H,12,14)(H,15,16)/t9-/m0/s1

InChIKey:

ZHZUEHHBTYJTKY-VIFPVBQESA-N

SMILES:

Software	SMILES
OpenEye OEToolkits 1.5.0	CC(=O)NCCCCC(C(=O)O)NC(=O)C
OpenEye OEToolkits 1.5.0	CC(=O)NCCCC[C@@H](C(=O)O)NC(=O)C
CACTVS 3.341	CC(=O)NCCCC[CH](NC(C)=O)C(O)=O
CACTVS 3.341	CC(=O)NCCCC[C@H](NC(C)=O)C(O)=O
ACDLabs 10.04	O=C(NC(C(=O)O)CCCCNC(=O)C)C

Name:

DI-ACETYL-LYSINE

ChEMBL:

CHEMBL1221839

ZINC:

ZINC000002560345

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).