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glutaurine(1-)

Go to external page http://purl.obolibrary.org/obo/CHEBI_140299

An organosulfonate oxoanion resulting from the deprotonation of the sulfonic acid moiety of glutaurine zwitterion. The major species at pH 7.3.

Term info

Label

glutaurine(1-)

Synonyms
  • (2S)-2-azaniumyl-5-oxo-5-[(2-sulfonatoethyl)amino]pentanoate
Subsets

3_STAR

IUPAC NAME
(2S)-2-azaniumyl-5-oxo-5-[(2-sulfonatoethyl)amino]pentanoate [ IUPAC ]

charge

-1

formula

C7H13N2O6S

has obo namespace

chebi_ontology

id

CHEBI:140299

inchi

InChI=1S/C7H14N2O6S/c8-5(7(11)12)1-2-6(10)9-3-4-16(13,14)15/h5H,1-4,8H2,(H,9,10)(H,11,12)(H,13,14,15)/p-1/t5-/m0/s1

inchikey

WGXUDTHMEITUBO-YFKPBYRVSA-M

mass

253.254

monoisotopicmass

253.04998

smiles

S(CCNC(CC[C@@H](C([O-])=O)[NH3+])=O)([O-])(=O)=O