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CHEBI:204470 - (2S)-2-acetamido-3-[4-hydroxy-3-(3-methylbut-2-enyl)phenyl]propanoic acid

ChEBI IDCHEBI:204470
ChEBI Name(2S)-2-acetamido-3-[4-hydroxy-3-(3-methylbut-2-enyl)phenyl]propanoic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H21NO4
Net Charge0
Average Mass291.347
Monoisotopic Mass291.14706
SMILESCC(=O)N[C@@H](Cc1ccc(O)c(CC=C(C)C)c1)C(=O)O
InChIInChI=1S/C16H21NO4/c1-10(2)4-6-13-8-12(5-7-15(13)19)9-14(16(20)21)17-11(3)18/h4-5,7-8,14,19H,6,9H2,1-3H3,(H,17,18)(H,20,21)/t14-/m0/s1
InChIKeyLJFWHSLCSLLNMJ-AWEZNQCLSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (18847278)
ChEBI Ontology
Outgoing Relation(s)
(2S)-2-acetamido-3-[4-hydroxy-3-(3-methylbut-2-enyl)phenyl]propanoic acid (CHEBI:204470) is a tyrosine derivative (CHEBI:62761)
IUPAC Name 
(2S)-2-acetamido-3-[4-hydroxy-3-(3-methylbut-2-enyl)phenyl]propanoic acid
Manual XrefsDatabases
28285859ChemSpider