SEQ2FUN

BioLiP

PDB CCD ID: BET
Number of entries in BioLiP: 0
Chemical formula: C5 H12 N O2
InChI: InChI=1S/C5H11NO2/c1-6(2,3)4-5(7)8/h4H2,1-3H3/p+1
InChIKey: KWIUHFFTVRNATP-UHFFFAOYSA-O
SMILES:
SoftwareSMILES
OpenEye OEToolkits 1.5.0C[N+](C)(C)CC(=O)O
CACTVS 3.341C[N+](C)(C)CC(O)=O
ACDLabs 10.04O=C(O)C[N+](C)(C)C
Name:TRIMETHYL GLYCINE
ChEMBL: CHEMBL95889
DrugBank: DB04455
ZINC: ZINC000001532728

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).