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CHEBI:197689 - Aschernaphthopyrone A

ChEBI IDCHEBI:197689
ChEBI NameAschernaphthopyrone A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC29H24O9
Net Charge0
Average Mass516.502
Monoisotopic Mass516.14203
SMILESCC1CC(=O)c2c(cc3c(-c4c(O)cc(O)c5c(O)c6c(cc45)CC(C)OC6=O)c(O)cc(O)c3c2O)C1
InChIInChI=1S/C29H24O9/c1-10-3-12-6-14-23(17(31)8-19(33)25(14)27(35)21(12)16(30)4-10)24-15-7-13-5-11(2)38-29(37)22(13)28(36)26(15)20(34)9-18(24)32/h6-11,31-36H,3-5H2,1-2H3
InChIKeyGQZZSZWQHSTSED-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Aschersonia (ncbitaxon:100986) - PubMed (20364867)
ChEBI Ontology
Outgoing Relation(s)
Aschernaphthopyrone A (CHEBI:197689) is a organic heterotricyclic compound (CHEBI:26979)
Aschernaphthopyrone A (CHEBI:197689) is a organooxygen compound (CHEBI:36963)
IUPAC Name 
7,9,10-trihydroxy-3-methyl-6-(2,4,10-trihydroxy-7-methyl-5-oxo-7,8-dihydro-6H-anthracen-1-yl)-3,4-dihydrobenzo[g]isochromen-1-one
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78434600ChemSpider