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CHEBI:39062 - 2-[(2-amino-2-oxoethyl)ammonio]ethanesulfonate

Default Structure
ChEBI IDCHEBI:39062
ChEBI Name2-[(2-amino-2-oxoethyl)ammonio]ethanesulfonate
Stars
Last Modified13 May 2011
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC4H10N2O4S
Net Charge0
Average Mass182.201
Monoisotopic Mass182.03613
SMILES[H][N+]([H])(CCS(=O)(=O)[O-])CC(N)=O
InChIInChI=1S/C4H10N2O4S/c5-4(7)3-6-1-2-11(8,9)10/h6H,1-3H2,(H2,5,7)(H,8,9,10)
InChIKeyDBXNUXBLKRLWFA-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Good's buffer substance  Any member of a collection of zwitterionic buffer substances selected or devised for suitability in experimental biological systems according to a number of predetermined criteria. Named after Dr. Norman Good.
Biological Role:
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-[(2-amino-2-oxoethyl)ammonio]ethanesulfonate (CHEBI:39062) is a 1,1-diunsubstituted alkanesulfonate (CHEBI:62081)
2-[(2-amino-2-oxoethyl)ammonio]ethanesulfonate (CHEBI:39062) is a ACES (CHEBI:39061)
2-[(2-amino-2-oxoethyl)ammonio]ethanesulfonate (CHEBI:39062) is tautomer of N-(2-acetamido)-2-aminoethanesulfonic acid (CHEBI:39060)
Incoming Relation(s)
N-(2-acetamido)-2-aminoethanesulfonic acid (CHEBI:39060) is tautomer of 2-[(2-amino-2-oxoethyl)ammonio]ethanesulfonate (CHEBI:39062)
IUPAC Name 
2-[(2-amino-2-oxoethyl)ammonio]ethanesulfonate