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CHEBI:217263 - Alternapyrone C

ChEBI IDCHEBI:217263
ChEBI NameAlternapyrone C
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SubmitterMetaboLights
DownloadsMolfile
FormulaC28H44O5
Net Charge0
Average Mass460.655
Monoisotopic Mass460.31887
SMILESCCC(C=C(C)CCCC(C=C(C)C=C(C)CC(C)c1oc(=O)c(C)c(O)c1C)CO)CO
InChIInChI=1S/C28H44O5/c1-8-24(16-29)14-18(2)10-9-11-25(17-30)15-20(4)12-19(3)13-21(5)27-22(6)26(31)23(7)28(32)33-27/h12,14-15,21,24-25,29-31H,8-11,13,16-17H2,1-7H3
InChIKeyBEOXKIXIEOFDGJ-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Parastagonospora nodorum (ncbitaxon:13684) - PubMed (30226784)
ChEBI Ontology
Outgoing Relation(s)
Alternapyrone C (CHEBI:217263) is a diterpene lactone (CHEBI:49193)
IUPAC Name 
6-[8,14-bis(hydroxymethyl)-4,6,12-trimethylhexadeca-4,6,12-trien-2-yl]-4-hydroxy-3,5-dimethylpyran-2-one
Manual XrefsDatabases
78444713ChemSpider