CHEBI:197927 - Isoharziandione

ChEBI IDCHEBI:197927
ChEBI NameIsoharziandione
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SubmitterMetaboLights
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FormulaC20H28O2
Net Charge0
Average Mass300.442
Monoisotopic Mass300.20893
SMILESCC1=C2CC(=O)C2(C)C2CC3C(=O)CC(C)C2(CC1)C3(C)C
InChIInChI=1S/C20H28O2/c1-11-6-7-20-12(2)8-15(21)14(18(20,3)4)9-16(20)19(5)13(11)10-17(19)22/h12,14,16H,6-10H2,1-5H3
InChIKeyPPAAOENVQWPYOV-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Trichoderma viride (ncbitaxon:5547) - DOI (10.1016/s0040-4020(97)00024-0)
ChEBI Ontology
Outgoing Relation(s)
Isoharziandione (CHEBI:197927) is a ketone (CHEBI:17087)
IUPAC Name 
4,8,14,15,15-pentamethyltetracyclo[9.3.1.01,9.05,8]pentadec-4-ene-7,12-dione
Manual XrefsDatabases
78443866ChemSpider