CHEBI:173766 - Epoxyoxophorone

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Epoxyoxophorone
ChEBI ID CHEBI:173766
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C9H12O3
Net Charge 0
Average Mass 168.192
Monoisotopic Mass 168.07864
InChI InChI=1S/C9H12O3/c1-8(2)4-5(10)6-9(3,12-6)7(8)11/h6H,4H2,1-3H3
InChIKey VOFRQXZPJRQJIW-UHFFFAOYSA-N
SMILES O1C2(C1C(=O)CC(C2=O)(C)C)C
ChEBI Ontology
Outgoing Epoxyoxophorone (CHEBI:173766) is a oxacycle (CHEBI:38104)
IUPAC Name
1,3,3-trimethyl-7-oxabicyclo[4.1.0]heptane-2,5-dione
Manual Xrefs Databases
3078355 ChemSpider
HMDB0032252 HMDB
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Registry Number Type Source
38284-11-6 CAS Registry Number ChemIDplus