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CHEBI:234109 - (3R)-atrochrysone carboxylic acid

ChEBI IDCHEBI:234109
ChEBI Name(3R)-atrochrysone carboxylic acid
Stars
ASCII Name(3R)-atrochrysone carboxylic acid
DefinitionAn atrochrysone carboxylic acid that has R-configuration.
Last Modified23 April 2025
SubmitterAdnan
DownloadsMolfile
FormulaC16H14O7
Net Charge0
Average Mass318.281
Monoisotopic Mass318.07395
SMILESC[C@@]1(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)/t12?,16-/m1/s1
InChIKeyVKCGEUGXAZNCKN-PVQCJRHBSA-N
Roles Classification
Chemical Roles:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Role:
fungal metabolite  Any eukaryotic metabolite produced during a metabolic reaction in fungi, the kingdom that includes microorganisms such as the yeasts and moulds.
ChEBI Ontology
Outgoing Relation(s)
(3R)-atrochrysone carboxylic acid (CHEBI:234109) is a atrochrysone carboxylic acid (CHEBI:234108)
(3R)-atrochrysone carboxylic acid (CHEBI:234109) is conjugate acid of (3R)-atrochrysone carboxylate (CHEBI:234107)
Incoming Relation(s)
(3R)-atrochrysone carboxylate (CHEBI:234107) is conjugate base of (3R)-atrochrysone carboxylic acid (CHEBI:234109)
IUPAC Name 
(3R)-3,6,8,9-tetrahydroxy-3-methyl-1-oxo-1,2,3,4-tetrahydroanthracene-2-carboxylic acid
Citations