CHEBI:104120 - α-methylene γ-butyrolactone

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ChEBI Name α-methylene γ-butyrolactone
ChEBI ID CHEBI:104120
ChEBI ASCII Name alpha-methylene gamma-butyrolactone
Definition A butan-4-olide having a methylene group at the 3-position.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information ChemicalBook:CB0290434, eMolecules:489856, ZINC000001740871
Download Molfile XML SDF
Formula C5H6O2
Net Charge 0
Average Mass 98.09990
Monoisotopic Mass 98.03678
InChI InChI=1S/C5H6O2/c1-4-2-3-7-5(4)6/h1-3H2
InChIKey GSLDEZOOOSBFGP-UHFFFAOYSA-N
SMILES C=C1CCOC1=O
Roles Classification
Application(s): gastrointestinal drug
A drug used for its effects on the gastrointestinal system, e.g. controlling gastric acidity, regulating gastrointestinal motility and water flow, and improving digestion.
anti-ulcer drug
One of various classes of drugs with different action mechanisms used to treat or ameliorate peptic ulcer or irritation of the gastrointestinal tract.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing α-methylene γ-butyrolactone (CHEBI:104120) has role anti-ulcer drug (CHEBI:49201)
α-methylene γ-butyrolactone (CHEBI:104120) has role gastrointestinal drug (CHEBI:55324)
α-methylene γ-butyrolactone (CHEBI:104120) is a butan-4-olide (CHEBI:22950)
Incoming anthecotulide (CHEBI:141397) has functional parent α-methylene γ-butyrolactone (CHEBI:104120)
IUPAC Name
3-methylideneoxolan-2-one
Synonyms Sources
3-Methylenedihydro-2(3H)-furanone NIST Chemistry WebBook
alpha-Methylene butyrolactone ChemIDplus
alpha-methylene gamma-butyrolactone ChEBI
α-methylene-γ-butyrolactone ChEBI
α-methylidene-γ-butyrolactone ChEBI
Dihydro-3-methylene-2(3H)-furanone ChemIDplus
Tulipalin A NIST Chemistry WebBook
tulipalin A UniProt
Registry Numbers Types Sources
107939 Reaxys Registry Number Reaxys
547-65-9 CAS Registry Number NIST Chemistry WebBook
547-65-9 CAS Registry Number ChemIDplus
746139 Gmelin Registry Number Gmelin
Citation
Cheminat A, Stampf JL, Benezra C (1984)
Allergic contact dermatitis to laurel (Laurus nobilis L.): isolation and identification of haptens.
Archives of dermatological research 276, 178-181 [PubMed:6476889]
[show Abstract]
Last Modified
21 December 2015