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CHEBI:214948 - Blanchaquinone

ChEBI IDCHEBI:214948
ChEBI NameBlanchaquinone
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC22H20O7
Net Charge0
Average Mass396.395
Monoisotopic Mass396.12090
SMILESCCCCC(=O)c1c(CC(=O)OC)cc2c(c1O)C(=O)c1c(O)cccc1C2=O
InChIInChI=1S/C22H20O7/c1-3-4-7-14(23)17-11(10-16(25)29-2)9-13-19(21(17)27)22(28)18-12(20(13)26)6-5-8-15(18)24/h5-6,8-9,24,27H,3-4,7,10H2,1-2H3
InChIKeyAEDYCMURUGEFML-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Streptomycesspecies (ncbitaxon:1931) - PubMed (15497950)
ChEBI Ontology
Outgoing Relation(s)
Blanchaquinone (CHEBI:214948) is a anthraquinone (CHEBI:22580)
IUPAC Name 
methyl 2-(4,5-dihydroxy-9,10-dioxo-3-pentanoylanthracen-2-yl)acetate
Manual XrefsDatabases
9340474ChemSpider