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CHEBI:3686 - chrysophanol-9-anthrone

Default Structure
ChEBI IDCHEBI:3686
ChEBI Namechrysophanol-9-anthrone
Stars
Last Modified26 May 2020
DownloadsMolfile
FormulaC15H12O3
Net Charge0
Average Mass240.258
Monoisotopic Mass240.07864
SMILESCc1cc(O)c2c(c1)Cc1cccc(O)c1C2=O
InChIInChI=1S/C15H12O3/c1-8-5-10-7-9-3-2-4-11(16)13(9)15(18)14(10)12(17)6-8/h2-6,16-17H,7H2,1H3
InChIKeyZZBWSNKBZKPGAK-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
chrysophanol-9-anthrone (CHEBI:3686) has functional parent anthralin (CHEBI:37510)
chrysophanol-9-anthrone (CHEBI:3686) is a anthracenes (CHEBI:46955)
IUPAC Name 
1,8-dihydroxy-3-methylanthracen-9(10H)-one
Synonyms  Source
1,8-dihydroxy-3-methyl-9(10H)-anthracenoneChemIDplus
1,8-dihydroxy-3-methylanthroneChemIDplus
ChrysarobinKEGG COMPOUND
Chrysophanic acid 9-anthroneKEGG COMPOUND
chrysophanol-9-anthroneChemIDplus
Chrysophanol anthroneKEGG COMPOUND
UniProt Name  Source
chrysophanol-9-anthroneUniProt
Manual XrefsDatabases
C00002806KNApSAcK
C10314KEGG COMPOUND
LMPK13040005LIPID MAPS
Registry NumbersSources
Beilstein:2333642Beilstein
CAS:491-58-7KEGG COMPOUND
CAS:491-58-7ChemIDplus