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CHEBI:71635 - versicolorone(1−)

Default Structure
ChEBI IDCHEBI:71635
ChEBI Nameversicolorone(1−)
Stars
ASCII Nameversicolorone(1-)
DefinitionAn organic anion that is the conjugate base of versicolorone, obtained by selective deprotonation of the 2-hydroxy group.
Last Modified21 January 2013
SubmitterKAX
DownloadsMolfile
FormulaC20H17O8
Net Charge-1
Average Mass385.348
Monoisotopic Mass385.09289
SMILESCC(=O)CCC(CO)c1c([O-])cc2c(c1O)C(=O)c1c(O)cc(O)cc1C2=O
InChIInChI=1S/C20H18O8/c1-8(22)2-3-9(7-21)15-14(25)6-12-17(19(15)27)20(28)16-11(18(12)26)4-10(23)5-13(16)24/h4-6,9,21,23-25,27H,2-3,7H2,1H3/p-1
InChIKeyHORUZDQRRJSTED-UHFFFAOYSA-M
ChEBI Ontology
Outgoing Relation(s)
versicolorone(1−) (CHEBI:71635) is a organic anion (CHEBI:25696)
versicolorone(1−) (CHEBI:71635) is conjugate base of versicolorone tricyclic form (CHEBI:71653)
Incoming Relation(s)
versicolorone tricyclic form (CHEBI:71653) is conjugate acid of versicolorone(1−) (CHEBI:71635)
IUPAC Name 
4,5,7-trihydroxy-3-(1-hydroxy-5-oxohexan-2-yl)-9,10-dioxo-9,10-dihydroanthracen-2-olate
Synonym  Source
versicolorone tricyclic form(1−)ChEBI
UniProt Name  Source
versicoloroneUniProt
Manual XrefsDatabases
CPD-10169MetaCyc
Citations