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CHEBI:203680 - Pyrenocine I

ChEBI IDCHEBI:203680
ChEBI NamePyrenocine I
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC11H14O4
Net Charge0
Average Mass210.229
Monoisotopic Mass210.08921
SMILESCOc1cc(=O)oc(C)c1/C=C/[C@H](C)O
InChIInChI=1S/C11H14O4/c1-7(12)4-5-9-8(2)15-11(13)6-10(9)14-3/h4-7,12H,1-3H3/b5-4+/t7-/m0/s1
InChIKeyPQGNXUDEWINQQV-KPJROHGDSA-N
Species of MetaboliteComponentSourceComments
Paecilomyces (ncbitaxon:33202) - PubMed (20588297)
ChEBI Ontology
Outgoing Relation(s)
Pyrenocine I (CHEBI:203680) is a pyranone (CHEBI:37963)
IUPAC Name 
5-[(E)-3-hydroxybut-1-enyl]-4-methoxy-6-methylpyran-2-one
Manual XrefsDatabases
28288016ChemSpider