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CHEBI:88174 - 7,9-di-tert-butyl-1-oxaspiro[4.5]deca-6,9-diene-2,8-dione

ChEBI IDCHEBI:88174
ChEBI Name7,9-di-tert-butyl-1-oxaspiro[4.5]deca-6,9-diene-2,8-dione
Stars
ASCII Name7,9-di-tert-butyl-1-oxaspiro[4.5]deca-6,9-diene-2,8-dione
DefinitionAn oxaspiro compound that is 1-oxaspiro[4.5]deca-6,9-diene-2,8-dione carrying two additional tert-butyl substituents at positions 7 and 9.
Last Modified23 May 2016
Submittermwilliams
DownloadsMolfile
FormulaC17H24O3
Net Charge0
Average Mass276.376
Monoisotopic Mass276.17254
SMILESCC(C)(C)C1=CC2(C=C(C(C)(C)C)C1=O)CCC(=O)O2
InChIInChI=1S/C17H24O3/c1-15(2,3)11-9-17(8-7-13(18)20-17)10-12(14(11)19)16(4,5)6/h9-10H,7-8H2,1-6H3
InChIKeyZTMZUYHXZPUDRF-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606)
- PubMed (26175011)
- MetaboLights (MTBLS226)
ChEBI Ontology
Outgoing Relation(s)
7,9-di-tert-butyl-1-oxaspiro[4.5]deca-6,9-diene-2,8-dione (CHEBI:88174) is a cyclic ketone (CHEBI:3992)
7,9-di-tert-butyl-1-oxaspiro[4.5]deca-6,9-diene-2,8-dione (CHEBI:88174) is a enone (CHEBI:51689)
7,9-di-tert-butyl-1-oxaspiro[4.5]deca-6,9-diene-2,8-dione (CHEBI:88174) is a lactone (CHEBI:25000)
7,9-di-tert-butyl-1-oxaspiro[4.5]deca-6,9-diene-2,8-dione (CHEBI:88174) is a oxaspiro compound (CHEBI:37948)
IUPAC Name 
7,9-di-tert-butyl-1-oxaspiro[4.5]deca-6,9-diene-2,8-dione
Registry NumbersSources
Reaxys:4752747Reaxys