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CHEBI:202222 - 6-Dehydropetasol

ChEBI IDCHEBI:202222
ChEBI Name6-Dehydropetasol
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H20O2
Net Charge0
Average Mass232.323
Monoisotopic Mass232.14633
SMILESC=C(C)C1=C[C@@]2(C)C(=CC1=O)CC[C@@H](O)[C@@H]2C
InChIInChI=1S/C15H20O2/c1-9(2)12-8-15(4)10(3)13(16)6-5-11(15)7-14(12)17/h7-8,10,13,16H,1,5-6H2,2-4H3/t10-,13+,15+/m0/s1
InChIKeyMMDLQPKGJNEWIM-PSOPSSQASA-N
Species of MetaboliteComponentSourceComments
Penicilliumspecies (ncbitaxon:5081) - PubMed (17191924)
ChEBI Ontology
Outgoing Relation(s)
6-Dehydropetasol (CHEBI:202222) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
(4aR,5R,6R)-6-hydroxy-4a,5-dimethyl-3-prop-1-en-2-yl-5,6,7,8-tetrahydronaphthalen-2-one
Manual XrefsDatabases
4439936ChemSpider