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

C8E

Summary
Name:(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE
Formula:C16 H34 O5
Formal charge:0
Formula weight:306.438 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs10.043,6,9,12-tetraoxaicosan-1-ol
OpenEye OEToolkits1.5.02-[2-[2-(2-octoxyethoxy)ethoxy]ethoxy]ethanol

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04O(CCCCCCCC)CCOCCOCCOCCO
SMILES_CANONICALCACTVS3.341CCCCCCCCOCCOCCOCCOCCO
SMILESCACTVS3.341CCCCCCCCOCCOCCOCCOCCO
SMILES_CANONICALOpenEye OEToolkits1.5.0CCCCCCCCOCCOCCOCCOCCO
SMILESOpenEye OEToolkits1.5.0CCCCCCCCOCCOCCOCCOCCO
InChIInChI1.03InChI=1S/C16H34O5/c1-2-3-4-5-6-7-9-18-11-13-20-15-16-21-14-12-19-10-8-17/h17H,2-16H2,1H3
InChIKeyInChI1.03FEOZZFHAVXYAMB-UHFFFAOYSA-N

227111

数据于2024-11-06公开中

PDB statisticsPDBj update infoContact PDBjnumon