P22

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Summary

Name:ETHYL DIHYDROGEN DIPHOSPHATE
Formula:C2 H8 O7 P2
Formal charge:0
Molecular weight:206.028 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs10.04ethyl trihydrogen diphosphate
OpenEye OEToolkits1.5.0ethyl phosphono hydrogen phosphate

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04O=P(OP(=O)(O)OCC)(O)O
SMILES_CANONICALCACTVS3.341CCO[P@@](O)(=O)O[P](O)(O)=O
SMILESCACTVS3.341CCO[P](O)(=O)O[P](O)(O)=O
SMILES_CANONICALOpenEye OEToolkits1.5.0CCO[P@](=O)(O)OP(=O)(O)O
SMILESOpenEye OEToolkits1.5.0CCOP(=O)(O)OP(=O)(O)O
InChIInChI1.03InChI=1S/C2H8O7P2/c1-2-8-11(6,7)9-10(3,4)5/h2H2,1H3,(H,6,7)(H2,3,4,5)
InChIKeyInChI1.03OJDJHGIXNZPZFD-UHFFFAOYSA-N