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Concept information

... > organooxygen compound > carbonyl compound > carboxylic acid > monocarboxylic acid > alpha,beta-unsaturated monocarboxylic acid > 3-(4,6-dihydroxy-3-oxocyclohexa-1,4-dien-1-yl)acrylic acid
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > organic hydroxy compound > enol > 3-(4,6-dihydroxy-3-oxocyclohexa-1,4-dien-1-yl)acrylic acid
... > organooxygen compound > carbonyl compound > ketone > alpha,beta-unsaturated ketone > enone > 3-(4,6-dihydroxy-3-oxocyclohexa-1,4-dien-1-yl)acrylic acid
... > organooxygen compound > carbonyl compound > ketone > cyclic ketone > alicyclic ketone > cyclohexenones > 3-(4,6-dihydroxy-3-oxocyclohexa-1,4-dien-1-yl)acrylic acid

Preferred term

3-(4,6-dihydroxy-3-oxocyclohexa-1,4-dien-1-yl)acrylic acid  

Type

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

charge

  • 0

formula

  • C9H8O5

has_functional_parent

inchi

  • InChI=1S/C9H8O5/c10-6-4-8(12)7(11)3-5(6)1-2-9(13)14/h1-4,6,10,12H,(H,13,14)

inchikey

  • ZDUUJTSRZWILGW-UHFFFAOYSA-N

mass

  • 196.157

monoisotopicmass

  • 196.03717

smiles

  • OC1C(=CC(=O)C(O)=C1)C=CC(O)=O

subset

  • 3_STAR

synonym EXACT

  • 3-(4,6-dihydroxy-3-oxocyclohexa-1,4-dien-1-yl)prop-2-enoic acid

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:133314

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