Record Information
Version1.0
StatusDetected and Quantified
Creation Date2021-05-14 23:43:15 UTC
Update Date2022-08-31 06:25:42 UTC
Metabolite IDMMDBc0006577
Metabolite Identification
Common NameCitreoviripyrone B
DescriptionCitreoviripyrone B belongs to the class of organic compounds known as pyranones and derivatives. Pyranones and derivatives are compounds containing a pyran ring which bears a ketone. Based on a literature review very few articles have been published on Citreoviripyrone B.
Structure
SynonymsNot Available
Molecular FormulaC14H16O3
Average Mass232.279
Monoisotopic Mass232.109944375
IUPAC Name6-[(1E,3E,5E)-hepta-1,3,5-trien-1-yl]-4-methoxy-5-methyl-2H-pyran-2-one
Traditional Name6-[(1E,3E,5E)-hepta-1,3,5-trien-1-yl]-4-methoxy-5-methylpyran-2-one
CAS Registry NumberNot Available
SMILES
[H]\C(C)=C(\[H])/C(/[H])=C(\[H])/C(/[H])=C(\[H])C1=C(C)C(OC)=CC(=O)O1
InChI Identifier
InChI=1S/C14H16O3/c1-4-5-6-7-8-9-12-11(2)13(16-3)10-14(15)17-12/h4-10H,1-3H3/b5-4+,7-6+,9-8+
InChI KeySXVWISLKTAUXGO-ZAJAATJQSA-N