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CHEBI:149683 - 2,3,6,8,9-pentahydroxy-1-oxo-3-(2-oxopropyl)-1,2,3,4-tetrahydroanthracene-2-carboxylate

ChEBI IDCHEBI:149683
ChEBI Name2,3,6,8,9-pentahydroxy-1-oxo-3-(2-oxopropyl)-1,2,3,4-tetrahydroanthracene-2-carboxylate
Stars
DefinitionCompound 8a
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC18H15O9
Net Charge-1
Average Mass375.309
Monoisotopic Mass375.07216
SMILESCC(=O)CC1(O)Cc2cc3cc(O)cc(O)c3c(O)c2C(=O)C1(O)C(=O)[O-]
InChIInChI=1S/C18H16O9/c1-7(19)5-17(26)6-9-2-8-3-10(20)4-11(21)12(8)14(22)13(9)15(23)18(17,27)16(24)25/h2-4,20-22,26-27H,5-6H2,1H3,(H,24,25)/p-1
InChIKeyVCTAIMOLJVTPNG-UHFFFAOYSA-M
ChEBI Ontology
Outgoing Relation(s)
2,3,6,8,9-pentahydroxy-1-oxo-3-(2-oxopropyl)-1,2,3,4-tetrahydroanthracene-2-carboxylate (CHEBI:149683) has functional parent asperthecin (CHEBI:64161)
2,3,6,8,9-pentahydroxy-1-oxo-3-(2-oxopropyl)-1,2,3,4-tetrahydroanthracene-2-carboxylate (CHEBI:149683) is a monocarboxylic acid anion (CHEBI:35757)
2,3,6,8,9-pentahydroxy-1-oxo-3-(2-oxopropyl)-1,2,3,4-tetrahydroanthracene-2-carboxylate (CHEBI:149683) is a α-hydroxy ketone (CHEBI:139588)
UniProt Name  Source
2,3,6,8,9-pentahydroxy-1-oxo-3-(2-oxopropyl)-1,2,3,4-tetrahydroanthracene-2-carboxylateUniProt
Citations