EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:144072 - 2-hexanoyl-1,3,8-trihydroxy-6-methoxy-anthraquinone

ChEBI IDCHEBI:144072
ChEBI Name2-hexanoyl-1,3,8-trihydroxy-6-methoxy-anthraquinone
Stars
Submittermwilliams
DownloadsMolfile
FormulaC21H20O7
Net Charge0
Average Mass384.384
Monoisotopic Mass384.12090
SMILESCCCCCC(=O)c1c(O)cc2c(c1O)C(=O)c1c(O)cc(OC)cc1C2=O
InChIInChI=1S/C21H20O7/c1-3-4-5-6-13(22)18-15(24)9-12-17(21(18)27)20(26)16-11(19(12)25)7-10(28-2)8-14(16)23/h7-9,23-24,27H,3-6H2,1-2H3
InChIKeyMLTVHORGISIISB-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
2-hexanoyl-1,3,8-trihydroxy-6-methoxy-anthraquinone (CHEBI:144072) is a polyketide (CHEBI:26188)
2-hexanoyl-1,3,8-trihydroxy-6-methoxy-anthraquinone (CHEBI:144072) is a trihydroxyanthraquinone (CHEBI:37488)