JQ5

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Summary

Name:4-[ethoxy(oxidanyl)phosphoryl]-4-oxidanylidene-butanoic acid
Formula:C6 H11 O6 P
Formal charge:0
Molecular weight:210.122 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.74-[ethoxy(oxidanyl)phosphoryl]-4-oxidanylidene-butanoic acid

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C6H11O6P/c1-2-12-13(10,11)6(9)4-3-5(7)8/h2-4H2,1H3,(H,7,8)(H,10,11)
InChIKeyInChI1.03YEJCRQSMXRSGOQ-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385CCO[P](O)(=O)C(=O)CCC(O)=O
SMILESCACTVS3.385CCO[P](O)(=O)C(=O)CCC(O)=O
SMILES_CANONICALOpenEye OEToolkits2.0.7CCOP(=O)(C(=O)CCC(=O)O)O
SMILESOpenEye OEToolkits2.0.7CCOP(=O)(C(=O)CCC(=O)O)O