CHEBI:36433 - α-angelica lactone

ChEBI IDCHEBI:36433
ChEBI Nameα-angelica lactone
Stars
ASCII Namealpha-angelica lactone
Last Modified2 December 2009
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC5H6O2
Net Charge0
Average Mass98.101
Monoisotopic Mass98.03678
SMILESCC1=CCC(=O)O1
InChIInChI=1S/C5H6O2/c1-4-2-3-5(6)7-4/h2H,3H2,1H3
InChIKeyQOTQFLOTGBBMEX-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
α-angelica lactone (CHEBI:36433) has functional parent but-3-en-4-olide (CHEBI:38120)
α-angelica lactone (CHEBI:36433) is a angelica lactone (CHEBI:36437)
α-angelica lactone (CHEBI:36433) is a butenolide (CHEBI:50523)
α-angelica lactone (CHEBI:36433) is tautomer of β-angelica lactone (CHEBI:36436)
Incoming Relation(s)
β-angelica lactone (CHEBI:36436) is tautomer of α-angelica lactone (CHEBI:36433)
IUPAC Name 
5-methylfuran-2(3H)-one
Synonyms  Source
α-angelica lactoneNIST Chemistry WebBook
Δ2-angelica lactoneNIST Chemistry WebBook
4-hydroxypent-3-enoic acid lactoneChemIDplus
γ-methyl-β,γ-crotonolactoneNIST Chemistry WebBook
4-hydroxy-3-pentenoic acid γ-lactoneNIST Chemistry WebBook
β,γ-angelica lactoneNIST Chemistry WebBook
Registry NumbersSources
Beilstein:108394Beilstein
Gmelin:719829Gmelin
CAS:591-12-8ChemIDplus
CAS:591-12-8NIST Chemistry WebBook