CHEBI:39076 - 3-(N-morpholiniumyl)propanesulfonate

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ChEBI Name 3-(N-morpholiniumyl)propanesulfonate
ChEBI ID CHEBI:39076
ChEBI ASCII Name 3-(N-morpholiniumyl)propanesulfonate
Definition A member of the class of MOPS that is morpholine substituted by a 3-sulfonatopropyl group at the nitrogen atom.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C7H15NO4S
Net Charge 0
Average Mass 209.26434
Monoisotopic Mass 209.07218
InChI InChI=1S/C7H15NO4S/c9-13(10,11)7-1-2-8-3-5-12-6-4-8/h1-7H2,(H,9,10,11)
InChIKey DVLFYONBTKHTER-UHFFFAOYSA-N
SMILES [H][N+]1(CCCS([O-])(=O)=O)CCOCC1
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 MOPS )
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ChEBI Ontology
Outgoing 3-(N-morpholiniumyl)propanesulfonate (CHEBI:39076) is a MOPS (CHEBI:39074)
3-(N-morpholiniumyl)propanesulfonate (CHEBI:39076) is conjugate acid of 3-(N-morpholino)propanesulfonate (CHEBI:39075)
3-(N-morpholiniumyl)propanesulfonate (CHEBI:39076) is tautomer of 3-(N-morpholino)propanesulfonic acid (CHEBI:44115)
Incoming 3-(N-morpholino)propanesulfonate (CHEBI:39075) is conjugate base of 3-(N-morpholiniumyl)propanesulfonate (CHEBI:39076)
3-(N-morpholino)propanesulfonic acid (CHEBI:44115) is tautomer of 3-(N-morpholiniumyl)propanesulfonate (CHEBI:39076)
IUPAC Name
3-morpholin-4-ium-4-ylpropane-1-sulfonate
Last Modified
03 July 2014