CHEBI:11946 - 4-(trimethylammonio)but-2-enoate

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 4-(trimethylammonio)but-2-enoate
ChEBI ID CHEBI:11946
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C7H13NO2
Net Charge 0
Average Mass 143.18366
Monoisotopic Mass 143.095
InChI InChI=1S/C7H13NO2/c1-8(2,3)6-4-5-7(9)10/h4-5H,6H2,1-3H3
InChIKey GUYHPGUANSLONG-UHFFFAOYSA-N
SMILES [H]C(C[N+](C)(C)C)=CC([O-])=O
ChEBI Ontology
Outgoing 4-(trimethylammonio)but-2-enoate (CHEBI:11946) has functional parent but-2-enoate (CHEBI:36258)
4-(trimethylammonio)but-2-enoate (CHEBI:11946) is a amino-acid betaine (CHEBI:22860)
4-(trimethylammonio)but-2-enoate (CHEBI:11946) is conjugate base of 4-(trimethylammonio)but-2-enoic acid (CHEBI:48867)
Incoming (E)-4-(trimethylammonio)but-2-enoate (CHEBI:17237) is a 4-(trimethylammonio)but-2-enoate (CHEBI:11946)
4-(trimethylammonio)but-2-enoic acid (CHEBI:48867) is conjugate acid of 4-(trimethylammonio)but-2-enoate (CHEBI:11946)
IUPAC Name
4-(trimethylammonio)but-2-enoate
Synonym Source
4-(trimethylammonio)but-2-enoate UniProt
Registry Number Type Source
3904235 Beilstein Registry Number Beilstein
Last Modified
14 March 2008