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CHEBI:214195 - Tricycloalternarene 3a

ChEBI IDCHEBI:214195
ChEBI NameTricycloalternarene 3a
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H30O3
Net Charge0
Average Mass330.468
Monoisotopic Mass330.21949
SMILESCC(C)=CCCC(C)C1=CCC2(C)OC3=C(CC12)C(=O)CCC3O
InChIInChI=1S/C21H30O3/c1-13(2)6-5-7-14(3)15-10-11-21(4)17(15)12-16-18(22)8-9-19(23)20(16)24-21/h6,10,14,17,19,23H,5,7-9,11-12H2,1-4H3
InChIKeyOAZOMSZXYCHYNG-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Alternaria chartarum (ncbitaxon:119957) - DOI (10.1007/bf00630356)
ChEBI Ontology
Outgoing Relation(s)
Tricycloalternarene 3a (CHEBI:214195) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
5-hydroxy-3a-methyl-1-(6-methylhept-5-en-2-yl)-3,5,6,7,9,9a-hexahydrocyclopenta[b]chromen-8-one
Manual XrefsDatabases
10259358ChemSpider