N(3)-(4-methoxyfumaroyl)-2,3-diaminopropionic acid (CHEBI:74407)

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ChEBI Name	N(3)-(4-methoxyfumaroyl)-2,3-diaminopropionic acid

ChEBI ID	CHEBI:74407

ChEBI ASCII Name	N(3)-(4-methoxyfumaroyl)-2,3-diaminopropionic acid

Definition	A monocarboxylic acid amide obtained by the formal condensation of the terminal amino group of 3-amino-L-alanine with the carboxy group of (2E)-4-methoxy-4-oxobut-2-enoic acid.

Stars	This entity has been manually annotated by the ChEBI Team.

Supplier Information

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Formula

C8H12N2O5

Net Charge

Average Mass

216.19130

Monoisotopic Mass

216.07462

InChI

InChI=1S/C8H12N2O5/c1-15-7(12)3-2-6(11)10-4-5(9)8(13)14/h2-3,5H,4,9H2,1H3,(H,10,11)(H,13,14)/b3-2+/t5-/m0/s1

InChIKey

IXTGTEFAVXEHRV-HRJJCQLASA-N

SMILES

COC(=O)\C=C\C(=O)NC[C@H](N)C(O)=O

Roles Classification
Biological Role(s):	metabolite Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.

ChEBI Ontology
Outgoing	N(3)-(4-methoxyfumaroyl)-2,3-diaminopropionic acid (CHEBI:74407) has functional parent 3-amino-L-alanine (CHEBI:16303) N(3)-(4-methoxyfumaroyl)-2,3-diaminopropionic acid (CHEBI:74407) has role metabolite (CHEBI:25212) N(3)-(4-methoxyfumaroyl)-2,3-diaminopropionic acid (CHEBI:74407) is a enoate ester (CHEBI:51702) N(3)-(4-methoxyfumaroyl)-2,3-diaminopropionic acid (CHEBI:74407) is a methyl ester (CHEBI:25248) N(3)-(4-methoxyfumaroyl)-2,3-diaminopropionic acid (CHEBI:74407) is a monocarboxylic acid amide (CHEBI:29347)

IUPAC Names

(2S)-2-amino-3-{[(2E)-4-methoxy-4-oxobut-2-enoyl]amino}propanoic acid

3-{[(2E)-4-methoxy-4-oxobut-2-enoyl]amino}-L-alanine

Synonym	Source
FMDP	ChemIDplus

Citation	Type	Source
21635214	PubMed citation	Europe PMC

Last Modified

03 March 2015