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CHEBI:88158 - 1,4-naphthoquinone-2-carboxylic acid

ChEBI IDCHEBI:88158
ChEBI Name1,4-naphthoquinone-2-carboxylic acid
Stars
DefinitionA dioxo monocarboxylic acid that is 1,4-naphthoquinone substituted at position 2 by a carboxy group.
Last Modified7 June 2016
SubmitterSteve
DownloadsMolfile
FormulaC11H6O4
Net Charge0
Average Mass202.165
Monoisotopic Mass202.02661
SMILESO=C(O)C1=CC(=O)c2ccccc2C1=O
InChIInChI=1S/C11H6O4/c12-9-5-8(11(14)15)10(13)7-4-2-1-3-6(7)9/h1-5H,(H,14,15)
InChIKeyUZSCBEJDBQICON-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
1,4-naphthoquinone-2-carboxylic acid (CHEBI:88158) has functional parent 1,4-naphthoquinone (CHEBI:27418)
1,4-naphthoquinone-2-carboxylic acid (CHEBI:88158) is a 1,4-naphthoquinones (CHEBI:132142)
1,4-naphthoquinone-2-carboxylic acid (CHEBI:88158) is a dioxo monocarboxylic acid (CHEBI:35951)
1,4-naphthoquinone-2-carboxylic acid (CHEBI:88158) is conjugate acid of 1,4-naphthoquinone-2-carboxylate (CHEBI:87842)
Incoming Relation(s)
1,4-naphthoquinone-2-carboxylate (CHEBI:87842) is conjugate base of 1,4-naphthoquinone-2-carboxylic acid (CHEBI:88158)
IUPAC Name 
1,4-dioxo-1,4-dihydronaphthalene-2-carboxylic acid
Synonym  Source
2-carboxy-1,4-naphthoquinoneChEBI
Manual XrefsDatabases
CPD-18334MetaCyc
Registry NumbersSources
Reaxys:2644241Reaxys