Loading
PDBj
MenuPDBj@FacebookPDBj@TwitterPDBj@YouTubewwPDB FoundationwwPDB
RCSB PDBPDBeBMRBAdv. SearchSearch help

8X3

Summary
Name:2-hydroxyethylsulfonic acid
Synonyms:2-oxidanylethanesulfonic acid
Formula:C2 H6 O4 S
Formal charge:0
Formula weight:126.132 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.62-oxidanylethanesulfonic acid

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C2H6O4S/c3-1-2-7(4,5)6/h3H,1-2H2,(H,4,5,6)
InChIKeyInChI1.03SUMDYPCJJOFFON-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385OCC[S](O)(=O)=O
SMILESCACTVS3.385OCC[S](O)(=O)=O
SMILES_CANONICALOpenEye OEToolkits2.0.6C(CS(=O)(=O)O)O
SMILESOpenEye OEToolkits2.0.6C(CS(=O)(=O)O)O

227111

건을2024-11-06부터공개중

PDB statisticsPDBj update infoContact PDBjnumon