CHEBI:173576 - alpha-Furyl methyl diketone

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
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 alpha-Furyl methyl diketone
ChEBI ID CHEBI:173576
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C7H6O3
Net Charge 0
Average Mass 138.122
Monoisotopic Mass 138.03169
InChI InChI=1S/C7H6O3/c1-5(8)7(9)6-3-2-4-10-6/h2-4H,1H3
InChIKey JXZJRYDTSDCGLO-UHFFFAOYSA-N
SMILES O1C(C(=O)C(=O)C)=CC=C1
ChEBI Ontology
Outgoing alpha-Furyl methyl diketone (CHEBI:173576) is a aromatic ketone (CHEBI:76224)
IUPAC Name
1-(uran-2-yl)propane-1,2-dione
Manual Xrefs Databases
66657 ChemSpider
HMDB0032920 HMDB
View more database links
Registry Number Type Source
1438-92-2 CAS Registry Number ChemIDplus