BioLiP

PDB

BioLiP

PDB CCD ID:

SNM

Number of entries in BioLiP:

Chemical formula:

C5 H11 N O3

InChI:

InChI=1S/C5H11NO3/c1-6(2)4(3-7)5(8)9/h4,7H,3H2,1-2H3,(H,8,9)/t4-/m0/s1

InChIKey:

UHOZUUWRLMQQBZ-BYPYZUCNSA-N

SMILES:

Software	SMILES
CACTVS 3.385	CN(C)[CH](CO)C(O)=O
OpenEye OEToolkits 2.0.6	CN(C)[C@@H](CO)C(=O)O
OpenEye OEToolkits 2.0.6	CN(C)C(CO)C(=O)O
CACTVS 3.385	CN(C)[C@@H](CO)C(O)=O

Name:

N,N-dimethyl-L-serine

ZINC:

ZINC000001677416

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).