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CHEBI:63318 - NDSB 221

Default Structure
ChEBI IDCHEBI:63318
ChEBI NameNDSB 221
Stars
DefinitionAn ammonium betaine derivative of 3-(piperidin-1-yl)propane-1-sulfonic acid. One of a group of non-detergent sulfobetaines having a sulfobetaine hydrophilic group and a short hydrophobic group that cannot aggregate to form micelles.
Last Modified2 December 2011
SubmitterVincent Fazio
DownloadsMolfile
FormulaC9H19NO3S
Net Charge0
Average Mass221.322
Monoisotopic Mass221.10856
SMILESC[N+]1(CCCS(=O)(=O)[O-])CCCCC1
InChIInChI=1S/C9H19NO3S/c1-10(6-3-2-4-7-10)8-5-9-14(11,12)13/h2-9H2,1H3
InChIKeyDQNQWAVIDNVATL-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
NDSB 221 (CHEBI:63318) is a ammonium betaine (CHEBI:35284)
IUPAC Name 
3-(1-methylpiperidinium-1-yl)propane-1-sulfonate
Synonyms  Source
3-(1-methylpiperidinio)-1-propanesulfonateSUBMITTER
3-(1-methylpiperidinium)-1-propane sulfonateSUBMITTER
non detergent sulfobetaine 221ChEBI
non-detergent sulfobetaine 221ChEBI
Registry NumbersSources
CAS:160788-56-7SUBMITTER