2-[bis(2-hydroxyethyl)ammonio]ethanesulfonate (CHEBI:39045)

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ChEBI Name	2-[bis(2-hydroxyethyl)ammonio]ethanesulfonate

ChEBI ID	CHEBI:39045

Stars	This entity has been manually annotated by the ChEBI Team.

Supplier Information

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Formula

C6H15NO5S

Net Charge

Average Mass

213.25304

Monoisotopic Mass

213.06709

InChI

InChI=1S/C6H15NO5S/c8-4-1-7(2-5-9)3-6-13(10,11)12/h8-9H,1-6H2,(H,10,11,12)

InChIKey

AJTVSSFTXWNIRG-UHFFFAOYSA-N

SMILES

[H][N+](CCO)(CCO)CCS([O-])(=O)=O

Roles Classification
Chemical Role(s):	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. (via BES ) Bronsted base A molecular entity capable of accepting a hydron from a donor (Bronsted acid). (via organic amino compound )

Biological Role(s):	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. (via 1,1-diunsubstituted alkanesulfonate )

ChEBI Ontology
Outgoing	2-[bis(2-hydroxyethyl)ammonio]ethanesulfonate (CHEBI:39045) is a 1,1-diunsubstituted alkanesulfonate (CHEBI:62081) 2-[bis(2-hydroxyethyl)ammonio]ethanesulfonate (CHEBI:39045) is a BES (CHEBI:39043) 2-[bis(2-hydroxyethyl)ammonio]ethanesulfonate (CHEBI:39045) is conjugate acid of 2-[bis(2-hydroxyethyl)amino]ethanesulfonate (CHEBI:39046) 2-[bis(2-hydroxyethyl)ammonio]ethanesulfonate (CHEBI:39045) is tautomer of 2-[bis(2-hydroxyethyl)amino]ethanesulfonic acid (CHEBI:39041)

Incoming	2-[bis(2-hydroxyethyl)amino]ethanesulfonate (CHEBI:39046) is conjugate base of 2-[bis(2-hydroxyethyl)ammonio]ethanesulfonate (CHEBI:39045) 2-[bis(2-hydroxyethyl)amino]ethanesulfonic acid (CHEBI:39041) is tautomer of 2-[bis(2-hydroxyethyl)ammonio]ethanesulfonate (CHEBI:39045)

IUPAC Name

2-[bis(2-hydroxyethyl)ammonio]ethanesulfonate

Last Modified

13 May 2011