CHEBI:176777 - 2(5H)-Furanone,5-ethyl

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 2(5H)-Furanone,5-ethyl
ChEBI ID CHEBI:176777
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C6H8O2
Net Charge 0
Average Mass 112.128
Monoisotopic Mass 112.05243
InChI InChI=1S/C6H8O2/c1-2-5-3-4-6(7)8-5/h3-5H,2H2,1H3
InChIKey GOUILHYTHSOMQJ-UHFFFAOYSA-N
SMILES O1C(CC)C=CC1=O
Metabolite of Species Details
Vitis vinifera (NCBI:txid29760) Found in leaf (BTO:0000713). See: MetaboLights Study
ChEBI Ontology
Outgoing 2(5H)-Furanone,5-ethyl (CHEBI:176777) is a butenolide (CHEBI:50523)
IUPAC Name
2-ethyl-2H-uran-5-one
Manual Xref Database
16103 ChemSpider
View more database links
Registry Number Type Source
2407-43-4 CAS Registry Number ChemIDplus