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CHEBI:181707 - 3-Hydroxy-3,8-dimethyl-5-(propan-2-ylidene)-1,2,3,3a,4,5,6,8a-octahydroazulen-6-one

Default Structure
ChEBI IDCHEBI:181707
ChEBI Name3-Hydroxy-3,8-dimethyl-5-(propan-2-ylidene)-1,2,3,3a,4,5,6,8a-octahydroazulen-6-one
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H22O2
Net Charge0
Average Mass234.339
Monoisotopic Mass234.16198
SMILESCC1=CC(=O)C(=C(C)C)CC2C1CCC2(C)O
InChIInChI=1S/C15H22O2/c1-9(2)12-8-13-11(5-6-15(13,4)17)10(3)7-14(12)16/h7,11,13,17H,5-6,8H2,1-4H3
InChIKeyRHBOHEXDGUVIIY-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
3-Hydroxy-3,8-dimethyl-5-(propan-2-ylidene)-1,2,3,3a,4,5,6,8a-octahydroazulen-6-one (CHEBI:181707) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
3-hydroxy-3,8-dimethyl-5-propan-2-ylidene-2,3a,4,8a-tetrahydro-1H-azulen-6-one
Manual XrefsDatabases
4478722ChemSpider
HMDB0036427HMDB