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Concept information

... > organooxygen compound > carbonyl compound > carboxylic acid > hydroxy carboxylic acid > 3-hydroxy carboxylic acid > 5-fluorocyclohexadiene-cis,cis-1,2-diol-1-carboxylate
... > organooxygen compound > carbonyl compound > carboxylic acid > monocarboxylic acid > cyclohexadienecarboxylic acid > 5-fluorocyclohexadiene-cis,cis-1,2-diol-1-carboxylate

Preferred term

5-fluorocyclohexadiene-cis,cis-1,2-diol-1-carboxylate  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

charge

  • 0

formula

  • C7H7FO4

inchi

  • InChI=1S/C7H7FO4/c8-4-1-2-5(9)7(12,3-4)6(10)11/h1-3,5,9,12H,(H,10,11)/t5-,7+/m1/s1

inchikey

  • SFLUOXSDNSKORB-VDTYLAMSSA-N

mass

  • 174.12650

monoisotopicmass

  • 174.03284

smiles

  • O[C@@H]1C=CC(F)=C[C@@]1(O)C(O)=O

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:80521

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