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CHEBI:133857 - azanigerone F

ChEBI IDCHEBI:133857
ChEBI Nameazanigerone F
Stars
DefinitionAn azaphilone that is 6H-2-benzopyran-6,8(7H)-dione carrying a 2-hydroxypropyl sunstyituent at position 3 as well as methyl and acetoxy substituents at position 7.
Last Modified2 March 2017
SubmitterJubra
DownloadsMolfile
FormulaC15H16O6
Net Charge0
Average Mass292.287
Monoisotopic Mass292.09469
SMILESCC(=O)OC1(C)C(=O)C=C2C=C(CC(C)O)OC=C2C1=O
InChIInChI=1S/C15H16O6/c1-8(16)4-11-5-10-6-13(18)15(3,21-9(2)17)14(19)12(10)7-20-11/h5-8,16H,4H2,1-3H3
InChIKeyBVMZQOLNAJZMBO-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Aspergillus niger ATCC 1015 (ncbitaxon:380704) - PubMed (22921072)
Roles Classification
Biological Roles:
Aspergillus metabolite  Any fungal metabolite produced during a metabolic reaction in the mould, Aspergillus .
fungal metabolite  Any eukaryotic metabolite produced during a metabolic reaction in fungi, the kingdom that includes microorganisms such as the yeasts and moulds.
ChEBI Ontology
Outgoing Relation(s)
azanigerone F (CHEBI:133857) has role Aspergillus metabolite (CHEBI:76956)
azanigerone F (CHEBI:133857) is a 2-benzopyran (CHEBI:38444)
azanigerone F (CHEBI:133857) is a acetate ester (CHEBI:47622)
azanigerone F (CHEBI:133857) is a azaphilone (CHEBI:50941)
azanigerone F (CHEBI:133857) is a cyclic ketone (CHEBI:3992)
azanigerone F (CHEBI:133857) is a polyketide (CHEBI:26188)
azanigerone F (CHEBI:133857) is a secondary alcohol (CHEBI:35681)
azanigerone F (CHEBI:133857) is a β-diketone (CHEBI:67265)
IUPAC Name 
3-(2-hydroxypropyl)-7-methyl-6,8-dioxo-7,8-dihydro-6H-2-benzopyran-7-yl acetate
Citations