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CHEBI:156141 - felinine zwitterion

ChEBI IDCHEBI:156141
ChEBI Namefelinine zwitterion
Stars
DefinitionA S-alkyl-L-cysteine zwitterion resulting from the transfer of a proton from the carboxy group to the amino group of felinine. Major microspecies at pH 7.3.
Last Modified15 July 2020
SubmitterAnne Morgat
DownloadsMolfile
FormulaC8H17NO3S
Net Charge0
Average Mass207.295
Monoisotopic Mass207.09291
SMILESCC(C)(CCO)SC[C@H]([NH3+])C(=O)[O-]
InChIInChI=1S/C8H17NO3S/c1-8(2,3-4-10)13-5-6(9)7(11)12/h6,10H,3-5,9H2,1-2H3,(H,11,12)/t6-/m0/s1
InChIKeyIFERABFGYYJODC-LURJTMIESA-N
ChEBI Ontology
Outgoing Relation(s)
felinine zwitterion (CHEBI:156141) is a S-alkyl-L-cysteine zwitterion (CHEBI:82710)
felinine zwitterion (CHEBI:156141) is tautomer of felinine (CHEBI:39390)
Incoming Relation(s)
felinine (CHEBI:39390) is tautomer of felinine zwitterion (CHEBI:156141)
IUPAC Name 
(2R)-2-azaniumyl-3-[(4-hydroxy-2-methylbutan-2-yl)sulfanyl]propanoate
Synonyms  Source
3-methyl-3-sulfanylbutan-1-ol-L-cysteine zwitterionSUBMITTER
S-3-(3-hydroxy-1,1-dimethylpropyl)-L-cysteine zwitterionSUBMITTER
UniProt Name  Source
3-methyl-3-sulfanylbutan-1-ol-L-cysteineUniProt
Manual XrefsDatabases
CPD-21113MetaCyc
Citations