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CHEBI:212800 - Stagonolide C

ChEBI IDCHEBI:212800
ChEBI NameStagonolide C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC10H16O4
Net Charge0
Average Mass200.234
Monoisotopic Mass200.10486
SMILESC[C@@H]1C[C@H](O)/C=C/[C@@H](O)CCC(=O)O1
InChIInChI=1S/C10H16O4/c1-7-6-9(12)3-2-8(11)4-5-10(13)14-7/h2-3,7-9,11-12H,4-6H2,1H3/b3-2+/t7-,8-,9-/m1/s1
InChIKeyDKWZZACTRIWLJJ-BKTAMIDGSA-N
Species of MetaboliteComponentSourceComments
Stagonospora cirsii (ncbitaxon:2772424) - PubMed (18088096)
ChEBI Ontology
Outgoing Relation(s)
Stagonolide C (CHEBI:212800) is a oxacycle (CHEBI:38104)
IUPAC Name 
(2R,4S,5E,7S)-4,7-dihydroxy-2-methyl-2,3,4,7,8,9-hexahydrooxecin-10-one
Manual XrefsDatabases
23314618ChemSpider