CHEBI:35900 - but-3-enoate

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name but-3-enoate
ChEBI ID CHEBI:35900
Definition A butenoate having the double bond at the 3-position.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C4H5O2
Net Charge -1
Average Mass 85.08130
Monoisotopic Mass 85.02950
InChI InChI=1S/C4H6O2/c1-2-3-4(5)6/h2H,1,3H2,(H,5,6)/p-1
InChIKey PVEOYINWKBTPIZ-UHFFFAOYSA-M
SMILES [O-]C(=O)CC=C
ChEBI Ontology
Outgoing but-3-enoate (CHEBI:35900) is a butenoate (CHEBI:36029)
but-3-enoate (CHEBI:35900) is conjugate base of but-3-enoic acid (CHEBI:35897)
Incoming (Z)-4-(2-hydroxy-5-sulfonatophenyl)-2-oxobut-3-enoate (CHEBI:18814) has functional parent but-3-enoate (CHEBI:35900)
4-(3-hydroxy-1-benzothiophen-2-yl)-2-oxobut-3-enoate (CHEBI:35904) has functional parent but-3-enoate (CHEBI:35900)
but-3-enoic acid (CHEBI:35897) is conjugate acid of but-3-enoate (CHEBI:35900)
IUPAC Name
but-3-enoate
Synonyms Sources
2-propenylcarboxylate ChEBI
3-butenoate ChEBI
β-butenoate ChEBI
Registry Numbers Types Sources
324288 Gmelin Registry Number Gmelin
4126564 Beilstein Registry Number Beilstein
Last Modified
26 October 2012
General Comment
2007-10-19 Should not be confused with vinyl acetate (CHEBI:46916).