CHEBI:57543 - 3-(uracil-1-yl)-L-alanine zwitterion

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 3-(uracil-1-yl)-L-alanine zwitterion
ChEBI ID CHEBI:57543
ChEBI ASCII Name 3-(uracil-1-yl)-L-alanine zwitterion
Definition Zwitterionic form of 3-(uracil-1-yl)-L-alanine having an anionic carboxy group and a protonated amino group.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C7H9N3O4
Net Charge 0
Average Mass 199.16410
Monoisotopic Mass 199.05931
InChI InChI=1S/C7H9N3O4/c8-4(6(12)13)3-10-2-1-5(11)9-7(10)14/h1-2,4H,3,8H2,(H,12,13)(H,9,11,14)/t4-/m0/s1
InChIKey FACUYWPMDKTVFU-BYPYZUCNSA-N
SMILES [NH3+][C@@H](Cn1ccc(=O)[nH]c1=O)C([O-])=O
ChEBI Ontology
Outgoing 3-(uracil-1-yl)-L-alanine zwitterion (CHEBI:57543) is a amino acid zwitterion (CHEBI:35238)
3-(uracil-1-yl)-L-alanine zwitterion (CHEBI:57543) is tautomer of 3-(uracil-1-yl)-L-alanine (CHEBI:15851)
Incoming 3-(uracil-1-yl)-L-alanine (CHEBI:15851) is tautomer of 3-(uracil-1-yl)-L-alanine zwitterion (CHEBI:57543)
IUPAC Name
(2S)-2-azaniumyl-3-(2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)propanoate
Synonyms Sources
(2S)-2-azaniumyl-3-(2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)propanoate ChEBI
3-(uracil-1-yl)-L-alanine UniProt
Last Modified
13 November 2017