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CHEBI:30661 - thyronine

ChEBI IDCHEBI:30661
ChEBI Namethyronine
Stars
DefinitionA tyrosine derivative where the phenolic hydrogen of tyrosine is substituted by 4-hydroxyphenyl.
Last Modified17 December 2014
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC15H15NO4
Net Charge0
Average Mass273.288
Monoisotopic Mass273.10011
SMILESNC(Cc1ccc(Oc2ccc(O)cc2)cc1)C(=O)O
InChIInChI=1S/C15H15NO4/c16-14(15(18)19)9-10-1-5-12(6-2-10)20-13-7-3-11(17)4-8-13/h1-8,14,17H,9,16H2,(H,18,19)
InChIKeyKKCIOUWDFWQUBT-UHFFFAOYSA-N
Roles Classification
Chemical Roles:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
thyronine (CHEBI:30661) is a non-proteinogenic α-amino acid (CHEBI:83925)
thyronine (CHEBI:30661) is a phenols (CHEBI:33853)
thyronine (CHEBI:30661) is a tyrosine derivative (CHEBI:62761)
Incoming Relation(s)
iodothyronine (CHEBI:24864) has functional parent thyronine (CHEBI:30661)
L-thyronine (CHEBI:30662) is a thyronine (CHEBI:30661)
IUPAC Name 
thyronine
Synonyms  Source
O-(4-hydroxyphenyl)-DL-tyrosineChemIDplus
2-amino-3-[4-(4-hydroxyphenoxy)phenyl]propanoic acidIUPAC
Registry NumbersSources
Gmelin:419747Gmelin
Reaxys:2947040Reaxys
CAS:1034-10-2ChemIDplus
Citations