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CHEBI:206592 - Solanapyrone R

ChEBI IDCHEBI:206592
ChEBI NameSolanapyrone R
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SubmitterMetaboLights
DownloadsMolfile
FormulaC19H24O4
Net Charge0
Average Mass316.397
Monoisotopic Mass316.16746
SMILESCCOc1cc([C@H]2[C@@H]3CCCC[C@@H]3C=C[C@@H]2C)oc(=O)c1C=O
InChIInChI=1S/C19H24O4/c1-3-22-16-10-17(23-19(21)15(16)11-20)18-12(2)8-9-13-6-4-5-7-14(13)18/h8-14,18H,3-7H2,1-2H3/t12-,13+,14+,18+/m0/s1
InChIKeyKCOWVKVOYPFKNH-HNSFDTNUSA-N
Species of MetaboliteComponentSourceComments
Alternaria (ncbitaxon:5598) - PubMed (25284429)
ChEBI Ontology
Outgoing Relation(s)
Solanapyrone R (CHEBI:206592) is a pyranone (CHEBI:37963)
IUPAC Name 
6-[(1R,2S,4aR,8aR)-2-methyl-1,2,4a,5,6,7,8,8a-octahydronaphthalen-1-yl]-4-ethoxy-2-oxopyran-3-carbaldehyde
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78442333ChemSpider