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211

Summary
Name:2,2',2''-NITRILOTRIETHANOL
Formula:C6 H15 N O3
Formal charge:0
Formula weight:149.188 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs10.042,2',2''-nitrilotriethanol
OpenEye OEToolkits1.5.02-(bis(2-hydroxyethyl)amino)ethanol

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04OCCN(CCO)CCO
SMILES_CANONICALCACTVS3.341OCCN(CCO)CCO
SMILESCACTVS3.341OCCN(CCO)CCO
SMILES_CANONICALOpenEye OEToolkits1.5.0C(CO)N(CCO)CCO
SMILESOpenEye OEToolkits1.5.0C(CO)N(CCO)CCO
InChIInChI1.03InChI=1S/C6H15NO3/c8-4-1-7(2-5-9)3-6-10/h8-10H,1-6H2
InChIKeyInChI1.03GSEJCLTVZPLZKY-UHFFFAOYSA-N

218853

PDB entries from 2024-04-24

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