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CHEBI:220568 - Variegatic acid

ChEBI IDCHEBI:220568
ChEBI NameVariegatic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H12O9
Net Charge0
Average Mass372.285
Monoisotopic Mass372.04813
SMILESO=C1O/C(=C(/C(=O)O)c2ccc(O)c(O)c2)C(O)=C1c1ccc(O)c(O)c1
InChIInChI=1S/C18H12O9/c19-9-3-1-7(5-11(9)21)13-15(23)16(27-18(13)26)14(17(24)25)8-2-4-10(20)12(22)6-8/h1-6,19-23H,(H,24,25)/b16-14+
InChIKeyMRRYHTCWZKZVIH-JQIJEIRASA-N
Species of MetaboliteComponentSourceComments
Suillus (ncbitaxon:5379) - DOI (10.1039/c1967000373b)
ChEBI Ontology
Outgoing Relation(s)
Variegatic acid (CHEBI:220568) is a catechols (CHEBI:33566)
IUPAC Name 
(2E)-2-(3,4-dihydroxyphenyl)-2-[4-(3,4-dihydroxyphenyl)-3-hydroxy-5-oxouran-2-ylidene]acetic acid
Manual XrefsDatabases
74025443ChemSpider