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CHEBI:205676 - Citreothiopyrane A

ChEBI IDCHEBI:205676
ChEBI NameCitreothiopyrane A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC9H12O2S
Net Charge0
Average Mass184.260
Monoisotopic Mass184.05580
SMILESCC(=O)C1=C(C)S[C@@H](C)CC1=O
InChIInChI=1S/C9H12O2S/c1-5-4-8(11)9(6(2)10)7(3)12-5/h5H,4H2,1-3H3/t5-/m0/s1
InChIKeyLFEVFDAFSDDIHB-YFKPBYRVSA-N
Species of MetaboliteComponentSourceComments
Penicillium (ncbitaxon:5073) - DOI (10.1016/s0040-4039(99)01408-2)
ChEBI Ontology
Outgoing Relation(s)
Citreothiopyrane A (CHEBI:205676) is a organic heteromonocyclic ring (CHEBI:52849)
Citreothiopyrane A (CHEBI:205676) is a organosulfur heterocyclic compound (CHEBI:38106)
IUPAC Name 
5-acetyl-2,6-dimethyl-2,3-dihydrothiopyran-4-one
Manual XrefsDatabases
8759016ChemSpider