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CHEBI:69533 - rubiadin

ChEBI IDCHEBI:69533
ChEBI Namerubiadin
Stars
DefinitionA dihydroxyanthraquinone that is anthracene-9,10-dione substituted by hydroxy groups at positions 1 and 3 and a methyl group at position 2. It has been isolated from Rubia yunnanensis.
Secondary ChEBI IDCHEBI:8906
Last Modified28 July 2014
DownloadsMolfile
FormulaC15H10O4
Net Charge0
Average Mass254.241
Monoisotopic Mass254.05791
SMILESCc1c(O)cc2c(c1O)C(=O)c1ccccc1C2=O
InChIInChI=1S/C15H10O4/c1-7-11(16)6-10-12(13(7)17)15(19)9-5-3-2-4-8(9)14(10)18/h2-6,16-17H,1H3
InChIKeyIRZTUXPRIUZXMP-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Rubia yunnanensis (IPNI:765385-1) root (BTO:0001188) PubMed (21973054) Methanolic extract of air dried powdered roots.
Roles Classification
Chemical Role:
antioxidant  A substance that opposes oxidation or inhibits reactions brought about by dioxygen or peroxides.
Biological Roles:
antibacterial agent  A substance (or active part thereof) that kills or slows the growth of bacteria.
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
Application:
hepatoprotective agent  Any compound that is able to prevent damage to the liver.
ChEBI Ontology
Outgoing Relation(s)
rubiadin (CHEBI:69533) has role antibacterial agent (CHEBI:33282)
rubiadin (CHEBI:69533) has role antioxidant (CHEBI:22586)
rubiadin (CHEBI:69533) has role hepatoprotective agent (CHEBI:62868)
rubiadin (CHEBI:69533) has role plant metabolite (CHEBI:76924)
rubiadin (CHEBI:69533) is a dihydroxyanthraquinone (CHEBI:37484)
IUPAC Name 
1,3-dihydroxy-2-methylanthracene-9,10-dione
Manual XrefsDatabases
C10402KEGG COMPOUND
KR20120033699Patent
C00002862KNApSAcK
Registry NumbersSources
Reaxys:1885558Reaxys
CAS:117-02-2KEGG COMPOUND
CAS:117-02-2ChemIDplus
Citations