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CHEBI:32970 - 2-aminoethanesulfonate

Default Structure
ChEBI IDCHEBI:32970
ChEBI Name2-aminoethanesulfonate
Stars
DefinitionA 1,1-diunsubstituted alkanesulfonate that is ethanesulfonate substituted by an amino group at position 2.
Last Modified26 February 2024
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC2H6NO3S
Net Charge-1
Average Mass124.141
Monoisotopic Mass124.00739
SMILESNCCS(=O)(=O)[O-]
InChIInChI=1S/C2H7NO3S/c3-1-2-7(4,5)6/h1-3H2,(H,4,5,6)/p-1
InChIKeyXOAAWQZATWQOTB-UHFFFAOYSA-M
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) - PubMed (17875433)
Roles Classification
Biological Roles:
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
xenobiotic  A xenobiotic (Greek, xenos "foreign"; bios "life") is a compound that is foreign to a living organism. Principal xenobiotics include: drugs, carcinogens and various compounds that have been introduced into the environment by artificial means.
ChEBI Ontology
Outgoing Relation(s)
2-aminoethanesulfonate (CHEBI:32970) has role human metabolite (CHEBI:77746)
2-aminoethanesulfonate (CHEBI:32970) has role mouse metabolite (CHEBI:75771)
2-aminoethanesulfonate (CHEBI:32970) is a 1,1-diunsubstituted alkanesulfonate (CHEBI:62081)
2-aminoethanesulfonate (CHEBI:32970) is conjugate base of taurine (CHEBI:15891)
Incoming Relation(s)
fatty acid-taurine conjugate(1−) (CHEBI:132040) has functional parent 2-aminoethanesulfonate (CHEBI:32970)
taurine (CHEBI:15891) is conjugate acid of 2-aminoethanesulfonate (CHEBI:32970)
IUPAC Name 
2-aminoethanesulfonate
Registry NumbersSources
Reaxys:3588289Reaxys