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P33

Summary
Name:3,6,9,12,15,18-HEXAOXAICOSANE-1,20-DIOL
Synonyms:HEPTAETHYLENE GLYCOL
PEG330
Formula:C14 H30 O8
Formal charge:0
Formula weight:326.383 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs10.043,6,9,12,15,18-hexaoxaicosane-1,20-diol
OpenEye OEToolkits1.5.02-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04O(CCOCCO)CCOCCOCCOCCOCCO
SMILES_CANONICALCACTVS3.341OCCOCCOCCOCCOCCOCCOCCO
SMILESCACTVS3.341OCCOCCOCCOCCOCCOCCOCCO
SMILES_CANONICALOpenEye OEToolkits1.5.0C(COCCOCCOCCOCCOCCOCCO)O
SMILESOpenEye OEToolkits1.5.0C(COCCOCCOCCOCCOCCOCCO)O
InChIInChI1.03InChI=1S/C14H30O8/c15-1-3-17-5-7-19-9-11-21-13-14-22-12-10-20-8-6-18-4-2-16/h15-16H,1-14H2
InChIKeyInChI1.03XPJRQAIZZQMSCM-UHFFFAOYSA-N

218853

PDB entries from 2024-04-24

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