EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:74323 - Leu-FMDP

ChEBI IDCHEBI:74323
ChEBI NameLeu-FMDP
Stars
DefinitionA dipeptide composed of 3-{[(2E)-4-methoxy-4-oxobut-2-enoyl]amino}alanine and L-leucine joined by peptide linkages.
Last Modified3 March 2015
Submittermwilliams
DownloadsMolfile
FormulaC14H23N3O6
Net Charge0
Average Mass329.353
Monoisotopic Mass329.15869
SMILESCOC(=O)/C=C/C(=O)NCC(N)C(=O)N[C@@H](CC(C)C)C(=O)O
InChIInChI=1S/C14H23N3O6/c1-8(2)6-10(14(21)22)17-13(20)9(15)7-16-11(18)4-5-12(19)23-3/h4-5,8-10H,6-7,15H2,1-3H3,(H,16,18)(H,17,20)(H,21,22)/b5-4+/t9?,10-/m0/s1
InChIKeyWMRULULWXGOKDR-VVMSLXPCSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
Leu-FMDP (CHEBI:74323) has functional parent L-leucine (CHEBI:15603)
Leu-FMDP (CHEBI:74323) has functional parent 3-aminoalanine (CHEBI:18383)
Leu-FMDP (CHEBI:74323) has role metabolite (CHEBI:25212)
Leu-FMDP (CHEBI:74323) is a dipeptide (CHEBI:46761)
Leu-FMDP (CHEBI:74323) is a methyl ester (CHEBI:25248)
IUPAC Name 
3-{[(2E)-4-methoxy-4-oxobut-2-enoyl]amino}alanyl-L-leucine
Manual XrefsDatabases
CPD0-1906MetaCyc