Record Information
Version1.0
StatusDetected and Quantified
Creation Date2021-05-15 00:17:40 UTC
Update Date2022-08-31 06:26:30 UTC
Metabolite IDMMDBc0006947
Metabolite Identification
Common NameDecarestrictine D
DescriptionDecarestrictine D, also known as tuckolide, belongs to the class of organic compounds known as oxocins. Oxocins are compounds containing an oxocin ring, which is a eight-member unsaturated aromatic ring containing one oxygen atom and seven carbon atoms. Decarestrictine D is an extremely weak basic (essentially neutral) compound (based on its pKa).
Structure
Synonyms
ValueSource
TuckolideMeSH
Molecular FormulaC10H16O5
Average Mass216.233
Monoisotopic Mass216.099773615
IUPAC Name4,5,8-trihydroxy-10-methyl-3,4,5,8,9,10-hexahydro-2H-oxecin-2-one
Traditional Name4,5,8-trihydroxy-10-methyl-3,4,5,8,9,10-hexahydrooxecin-2-one
CAS Registry NumberNot Available
SMILES
CC1CC(O)C=CC(O)C(O)CC(=O)O1
InChI Identifier
InChI=1S/C10H16O5/c1-6-4-7(11)2-3-8(12)9(13)5-10(14)15-6/h2-3,6-9,11-13H,4-5H2,1H3
InChI KeyHWMMWMJBUOCCFZ-UHFFFAOYSA-N