CHEBI:74501 - Tyr-FMDP

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ChEBI Name Tyr-FMDP
ChEBI ID CHEBI:74501
Definition A dipeptide composed of 3-{[(2E)-4-methoxy-4-oxobut-2-enoyl]amino}alanine and L-tyrosine joined by peptide linkages.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C17H21N3O7
Net Charge 0
Average Mass 379.36450
Monoisotopic Mass 379.13795
InChI InChI=1S/C17H21N3O7/c1-27-15(23)7-6-14(22)19-9-13(17(25)26)20-16(24)12(18)8-10-2-4-11(21)5-3-10/h2-7,12-13,21H,8-9,18H2,1H3,(H,19,22)(H,20,24)(H,25,26)/b7-6+/t12-,13?/m0/s1
InChIKey GHFSCLVMNYRWQP-LOJZCDLVSA-N
SMILES COC(=O)\C=C\C(=O)NCC(NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(O)=O
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
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ChEBI Ontology
Outgoing Tyr-FMDP (CHEBI:74501) has functional parent 3-aminoalanine (CHEBI:18383)
Tyr-FMDP (CHEBI:74501) has functional parent L-tyrosine (CHEBI:17895)
Tyr-FMDP (CHEBI:74501) has role metabolite (CHEBI:25212)
Tyr-FMDP (CHEBI:74501) is a dicarboxylic acid monoester (CHEBI:36244)
Tyr-FMDP (CHEBI:74501) is a dipeptide (CHEBI:46761)
Tyr-FMDP (CHEBI:74501) is a methyl ester (CHEBI:25248)
IUPAC Names
2-{[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino}-3-{[(2E)-4-methoxy-4-oxobut-2-enoyl]amino}propanoic acid
L-tyrosyl-3-{[(2E)-4-methoxy-4-oxobut-2-enoyl]amino}alanine
Manual Xref Database
CPD0-1913 MetaCyc
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Last Modified
03 March 2015