SEQ2FUN

BioLiP

PDB CCD ID: ESA
Number of entries in BioLiP: 9
Chemical formula: C2 H6 O3 S
InChI: InChI=1S/C2H6O3S/c1-2-6(3,4)5/h2H2,1H3,(H,3,4,5)
InChIKey: CCIVGXIOQKPBKL-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 1.5.0CCS(=O)(=O)O
ACDLabs 10.04O=S(=O)(O)CC
CACTVS 3.341CC[S](O)(=O)=O
Name:ETHANESULFONIC ACID
DrugBank: DB03635
ZINC: ZINC000003861350
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).