3-formyl-L-tyrosinyl-L-threonine (CHEBI:202422)

EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:202422 - 3-formyl-L-tyrosinyl-L-threonine

Take structure to advanced search

ChEBI ID	CHEBI:202422
ChEBI Name	3-formyl-L-tyrosinyl-L-threonine
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C14H18N2O6
Net Charge	0
Average Mass	310.306
Monoisotopic Mass	310.11649
SMILES	C[C@@H](O)[C@H](NC(=O)[C@@H](N)Cc1ccc(O)c(C=O)c1)C(=O)O
InChI	InChI=1S/C14H18N2O6/c1-7(18)12(14(21)22)16-13(20)10(15)5-8-2-3-11(19)9(4-8)6-17/h2-4,6-7,10,12,18-19H,5,15H2,1H3,(H,16,20)(H,21,22)/t7-,10+,12+/m1/s1
InChIKey	CLSAEXZTTQJZHA-VHRDEZTHSA-N

Species of Metabolite	Component	Source	Comments
Pseudoalteromonas tunicata (ncbitaxon:314281)	-	PubMed (20041686)

Roles Classification

Bronsted base A molecular entity capable of accepting a hydron from a donor (Brønsted acid).

ChEBI Ontology

Outgoing Relation(s)
	3-formyl-L-tyrosinyl-L-threonine (CHEBI:202422) is a dipeptide (CHEBI:46761)

IUPAC Name
(2S,3R)-2-[[(2S)-2-amino-3-(3-ormyl-4-hydroxyphenyl)propanoyl]amino]-3-hydroxybutanoic acid

Manual Xrefs	Databases
27024561	ChemSpider