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CHEBI:214091 - Cladobotrin III

ChEBI IDCHEBI:214091
ChEBI NameCladobotrin III
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H12O6
Net Charge0
Average Mass252.222
Monoisotopic Mass252.06339
SMILESCOC(=O)/C=C/c1oc(=O)c(C)c(OC)c1C=O
InChIInChI=1S/C12H12O6/c1-7-11(17-3)8(6-13)9(18-12(7)15)4-5-10(14)16-2/h4-6H,1-3H3/b5-4+
InChIKeyAOUIWFQBPLFLEE-SNAWJCMRSA-N
Species of MetaboliteComponentSourceComments
Hypomyces aurantius (ncbitaxon:29852) - DOI (10.1248/cpb.42.2612)
ChEBI Ontology
Outgoing Relation(s)
Cladobotrin III (CHEBI:214091) is a pyranone (CHEBI:37963)
IUPAC Name 
methyl (E)-3-(3-ormyl-4-methoxy-5-methyl-6-oxopyran-2-yl)prop-2-enoate
Manual XrefsDatabases
8439672ChemSpider