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

21H

Summary
Name:oxydimethanol
Formula:C2 H6 O3
Formal charge:0
Formula weight:78.067 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.01oxydimethanol
OpenEye OEToolkits1.7.6hydroxymethyloxymethanol

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01OCOCO
InChIInChI1.03InChI=1S/C2H6O3/c3-1-5-2-4/h3-4H,1-2H2
InChIKeyInChI1.03ARZLUCYKIWYSHR-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385OCOCO
SMILESCACTVS3.385OCOCO
SMILES_CANONICALOpenEye OEToolkits1.7.6C(O)OCO
SMILESOpenEye OEToolkits1.7.6C(O)OCO

222926

PDB entries from 2024-07-24

PDB statisticsPDBj update infoContact PDBjnumon