CHEBI:1774 - (E)-4-(trimethylammonio)but-2-enoic acid

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name (E)-4-(trimethylammonio)but-2-enoic acid
ChEBI ID CHEBI:1774
ChEBI ASCII Name (E)-4-(trimethylammonio)but-2-enoic acid
Definition A 4-(trimethylammonio)but-2-enoic acid with a (E)-configuration at the double bond.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C7H14NO2
Net Charge +1
Average Mass 144.19160
Monoisotopic Mass 144.102
InChI InChI=1S/C7H13NO2/c1-8(2,3)6-4-5-7(9)10/h4-5H,6H2,1-3H3/p+1/b5-4+
InChIKey GUYHPGUANSLONG-SNAWJCMRSA-O
SMILES C[N+](C)(C)C\C=C\C(O)=O
ChEBI Ontology
Outgoing (E)-4-(trimethylammonio)but-2-enoic acid (CHEBI:1774) is a 4-(trimethylammonio)but-2-enoic acid (CHEBI:48867)
(E)-4-(trimethylammonio)but-2-enoic acid (CHEBI:1774) is conjugate acid of (E)-4-(trimethylammonio)but-2-enoate (CHEBI:17237)
Incoming (E)-4-(trimethylammonio)but-2-enoyl-CoA (CHEBI:61123) has functional parent (E)-4-(trimethylammonio)but-2-enoic acid (CHEBI:1774)
(E)-4-(trimethylammonio)but-2-enoate (CHEBI:17237) is conjugate base of (E)-4-(trimethylammonio)but-2-enoic acid (CHEBI:1774)
IUPAC Name
(2E)-3-carboxy-N,N,N-trimethylprop-2-en-1-aminium
Synonym Source
4-(Trimethylammonio)but-2-enoate KEGG COMPOUND
Manual Xref Database
C04114 KEGG COMPOUND
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Registry Numbers Types Sources
1764693 Reaxys Registry Number Reaxys
1764693 Beilstein Registry Number Beilstein
Last Modified
02 February 2015