SEQ2FUN

BioLiP

PDB CCD ID: ETZ
Number of entries in BioLiP: 0
Chemical formula: C4 H10 O
InChI: InChI=1S/C4H10O/c1-3-5-4-2/h3-4H2,1-2H3
InChIKey: RTZKZFJDLAIYFH-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
CACTVS 3.370
OpenEye OEToolkits 1.7.6		CCOCC
ACDLabs 12.01ethoxyethane
Name:diethyl ether
ChEMBL: CHEMBL16264
DrugBank: DB13598
ZINC: ZINC000001657408
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).