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CHEBI:213269 - Cladosacid

ChEBI IDCHEBI:213269
ChEBI NameCladosacid
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SubmitterMetaboLights
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FormulaC15H22O3
Net Charge0
Average Mass250.338
Monoisotopic Mass250.15689
SMILESCC1=CC(=O)CC(C)(C)[C@H]1CC/C(C)=C/C(=O)O
InChIInChI=1S/C15H22O3/c1-10(7-14(17)18)5-6-13-11(2)8-12(16)9-15(13,3)4/h7-8,13H,5-6,9H2,1-4H3,(H,17,18)/b10-7+/t13-/m0/s1
InChIKeyZFJSQMZNZSWOPM-RSPDNQDQSA-N
Species of MetaboliteComponentSourceComments
Cladosporiumspecies OUCMDZ-1635 (ncbitaxon:1770537) - PubMed (29470403)
ChEBI Ontology
Outgoing Relation(s)
Cladosacid (CHEBI:213269) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
(E)-3-methyl-5-[(1R)-2,6,6-trimethyl-4-oxocyclohex-2-en-1-yl]pent-2-enoic acid
Manual XrefsDatabases
64868954ChemSpider