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CHEBI:217329 - Pyrenocine M

ChEBI IDCHEBI:217329
ChEBI NamePyrenocine M
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H18O4
Net Charge0
Average Mass226.272
Monoisotopic Mass226.12051
SMILESCCCCCc1oc(=O)cc(OC)c1CO
InChIInChI=1S/C12H18O4/c1-3-4-5-6-10-9(8-13)11(15-2)7-12(14)16-10/h7,13H,3-6,8H2,1-2H3
InChIKeyMHWLDZQZIGJTLJ-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Phomopsisspecies (ncbitaxon:1715245) - PubMed (22233864)
ChEBI Ontology
Outgoing Relation(s)
Pyrenocine M (CHEBI:217329) is a pyranone (CHEBI:37963)
IUPAC Name 
5-(hydroxymethyl)-4-methoxy-6-pentylpyran-2-one
Manual XrefsDatabases
31116300ChemSpider