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CHEBI:176469 - Trimethyltyrosine

ChEBI IDCHEBI:176469
ChEBI NameTrimethyltyrosine
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H17NO3
Net Charge0
Average Mass223.272
Monoisotopic Mass223.12084
SMILESCN(C)[C@@](C)(Cc1ccc(O)cc1)C(=O)O
InChIInChI=1S/C12H17NO3/c1-12(11(15)16,13(2)3)8-9-4-6-10(14)7-5-9/h4-7,14H,8H2,1-3H3,(H,15,16)/t12-/m0/s1
InChIKeyKOHIPRUAATWABH-LBPRGKRZSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) urine (BTO:0001419) MetaboLights (MTBLS2295)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
Trimethyltyrosine (CHEBI:176469) is a benzenes (CHEBI:22712)
Trimethyltyrosine (CHEBI:176469) is a monocarboxylic acid (CHEBI:25384)
IUPAC Name 
(2S)-2-(dimethylamino)-3-(4-hydroxyphenyl)-2-methylpropanoic acid