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Obsolete: CRY

CRY was replaced with GOL on
Summary
Name:PROPANE-1,2,3-TRIOL
Synonyms:GLYCEROL
Formula:C3 H8 O3
Formal charge:0
Formula weight:92.094 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs10.04propane-1,2,3-triol
OpenEye OEToolkits1.5.0propane-1,2,3-triol

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04OCC(O)CO
InChIInChI1.02bInChI=1/C3H8O3/c4-1-3(6)2-5/h3-6H,1-2H2
InChIKeyInChI1.02bPEDCQBHIVMGVHV-UHFFFAOYAF
SMILES_CANONICALCACTVS3.341OCC(O)CO
SMILESCACTVS3.341OCC(O)CO
SMILES_CANONICALOpenEye OEToolkits1.5.0C(C(CO)O)O
SMILESOpenEye OEToolkits1.5.0C(C(CO)O)O

218853

数据于2024-04-24公开中

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