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CHEBI:149713 - atrochrysone carboxylate

ChEBI IDCHEBI:149713
ChEBI Nameatrochrysone carboxylate
Stars
DefinitionA hydroxy monocarboxylic acid anion that is the conjugate base of atrochrysone carboxylic acid resulting from the deprotonation of the carboxy group; Major species at pH 7.3.
Last Modified24 April 2025
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC16H13O7
Net Charge-1
Average Mass317.273
Monoisotopic Mass317.06668
SMILESCC1(O)Cc2cc3cc(O)cc(O)c3c(O)c2C(=O)C1C(=O)[O-]
InChIInChI=1S/C16H14O7/c1-16(23)5-7-2-6-3-8(17)4-9(18)10(6)13(19)11(7)14(20)12(16)15(21)22/h2-4,12,17-19,23H,5H2,1H3,(H,21,22)/p-1
InChIKeyVKCGEUGXAZNCKN-UHFFFAOYSA-M
ChEBI Ontology
Outgoing Relation(s)
atrochrysone carboxylate (CHEBI:149713) is a hydroxy monocarboxylic acid anion (CHEBI:36059)
atrochrysone carboxylate (CHEBI:149713) is conjugate base of atrochrysone carboxylic acid (CHEBI:234108)
Incoming Relation(s)
(3R)-atrochrysone carboxylate (CHEBI:234107) is a atrochrysone carboxylate (CHEBI:149713)
atrochrysone carboxylic acid (CHEBI:234108) is conjugate acid of atrochrysone carboxylate (CHEBI:149713)
IUPAC Name 
3,6,8,9-tetrahydroxy-3-methyl-1-oxo-1,2,3,4-tetrahydroanthracene-2-carboxylate
Synonyms  Source
atrochrysone carboxylic acid anionChEBI
atrochrysone carboxylic acid(1−)ChEBI
Manual XrefsDatabases
CPD-23476MetaCyc
Citations