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CHEBI:233626 - 6-{[(2S)-1-phenylpropan-2-yl]amino}hexane-1-thiol

ChEBI IDCHEBI:233626
ChEBI Name6-{[(2S)-1-phenylpropan-2-yl]amino}hexane-1-thiol
Stars
ASCII Name6-{[(2S)-1-phenylpropan-2-yl]amino}hexane-1-thiol
DefinitionA thiol that is 6-aminohexane-1-thiol in which the amino group is substituted by a [(2S)-1-phenylpropan-2-yl]amino group.
Last Modified6 March 2025
SubmitterAdnan
DownloadsMolfile
FormulaC15H25NS
Net Charge0
Average Mass251.439
Monoisotopic Mass251.17077
SMILESC[C@@H](Cc1ccccc1)NCCCCCCS
InChIInChI=1S/C15H25NS/c1-14(13-15-9-5-4-6-10-15)16-11-7-2-3-8-12-17/h4-6,9-10,14,16-17H,2-3,7-8,11-13H2,1H3/t14-/m0/s1
InChIKeyQBJNZLOYWBZWRP-AWEZNQCLSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Biological Role:
hapten  Any substance capable of eliciting an immune response only when attached to a large carrier such as a protein. Examples include dinitrophenols; oligosaccharides; peptides; and heavy metals.
ChEBI Ontology
Outgoing Relation(s)
6-{[(2S)-1-phenylpropan-2-yl]amino}hexane-1-thiol (CHEBI:233626) has role hapten (CHEBI:59174)
6-{[(2S)-1-phenylpropan-2-yl]amino}hexane-1-thiol (CHEBI:233626) is a benzenes (CHEBI:22712)
6-{[(2S)-1-phenylpropan-2-yl]amino}hexane-1-thiol (CHEBI:233626) is a secondary amino compound (CHEBI:50995)
6-{[(2S)-1-phenylpropan-2-yl]amino}hexane-1-thiol (CHEBI:233626) is a thiol (CHEBI:29256)
IUPAC Name 
6-{[(2S)-1-phenylpropan-2-yl]amino}hexane-1-thiol
Synonym  Source
MH6ChEBI
Citations