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Chemistry, part 2

Content language

Contact us: CRM@email.irandoc.ac.ir

Concept information

... > organooxygen compound > carbonyl compound > carboxylic acid > monocarboxylic acid > alpha,beta-unsaturated monocarboxylic acid > caffeic acid quinone
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic oxo compound > carbonyl compound > carboxylic acid > monocarboxylic acid > alpha,beta-unsaturated monocarboxylic acid > caffeic acid quinone
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > carboxylic acid > monocarboxylic acid > alpha,beta-unsaturated monocarboxylic acid > caffeic acid quinone
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic acid > carboxylic acid > monocarboxylic acid > alpha,beta-unsaturated monocarboxylic acid > caffeic acid quinone
... > organooxygen compound > carbonyl compound > ketone > cyclic ketone > quinone > orthoquinones > 1,2-benzoquinones > caffeic acid quinone
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic oxo compound > carbonyl compound > ketone > cyclic ketone > quinone > orthoquinones > 1,2-benzoquinones > caffeic acid quinone
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > ketone > cyclic ketone > quinone > orthoquinones > 1,2-benzoquinones > caffeic acid quinone

Preferred term

caffeic acid quinone  

Type

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

Broader concept

alt_id

  • CHEBI:80759

charge

  • 0

formula

  • C9H6O4

has_functional_parent

has_role

inchi

  • InChI=1S/C9H6O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5H,(H,12,13)/b4-2+

inchikey

  • QPYQKHOKNCVKGE-DUXPYHPUSA-N

mass

  • 178.142

monoisotopicmass

  • 178.02661

smiles

  • O=C1C=C(C=CC1=O)/C=C/C(O)=O

subset

  • 3_STAR

synonym EXACT

  • (2E)-3-(3,4-dioxocyclohexa-1,5-dien-1-yl)prop-2-enoic acid

synonym RELATED

  • 3-(2-propenoic acid)-o-benzoquinone
  • 3-(3,4-dioxocyclohexa-1,5-dien-1-yl)acrylic acid
  • caffeic acid o-quinone
  • caffeoquinone

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:133316

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