CHEBI:176673 - N-[(E)-{[(Z)-2-amino-1,2-dicyanoethenyl]imino}methyl]phenylalanine

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ChEBI Name N-[(E)-{[(Z)-2-amino-1,2-dicyanoethenyl]imino}methyl]phenylalanine
ChEBI ID CHEBI:176673
ChEBI ASCII Name N-[(E)-{[(Z)-2-amino-1,2-dicyanoethenyl]imino}methyl]phenylalanine
Definition A phenylalanine derivative that is phenylalanine in which the amino group is substituted by a [(E)-{[(Z)-2-amino-1,2-dicyanoethenyl]imino}methyl]amino group. It is a chemical intermediate for nucleotide synthesis.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter kalra
Supplier Information
Download Molfile XML SDF
Formula C14H13N5O2
Net Charge 0
Average Mass 283.291
Monoisotopic Mass 283.10692
InChI InChI=1S/C14H13N5O2/c15-7-11(17)13(8-16)19-9-18-12(14(20)21)6-10-4-2-1-3-5-10/h1-5,9,12H,6,17H2,(H,18,19)(H,20,21)/b13-11-
InChIKey WWXJFLKNBPEVCZ-QBFSEMIESA-N
SMILES N\C(C#N)=C(/N=C/NC(CC1=CC=CC=C1)C(O)=O)\C#N
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing N-[(E)-{[(Z)-2-amino-1,2-dicyanoethenyl]imino}methyl]phenylalanine (CHEBI:176673) is a benzenes (CHEBI:22712)
N-[(E)-{[(Z)-2-amino-1,2-dicyanoethenyl]imino}methyl]phenylalanine (CHEBI:176673) is a dinitrile (CHEBI:51308)
N-[(E)-{[(Z)-2-amino-1,2-dicyanoethenyl]imino}methyl]phenylalanine (CHEBI:176673) is a enamine (CHEBI:47989)
N-[(E)-{[(Z)-2-amino-1,2-dicyanoethenyl]imino}methyl]phenylalanine (CHEBI:176673) is a imine (CHEBI:24783)
N-[(E)-{[(Z)-2-amino-1,2-dicyanoethenyl]imino}methyl]phenylalanine (CHEBI:176673) is a monocarboxylic acid (CHEBI:25384)
N-[(E)-{[(Z)-2-amino-1,2-dicyanoethenyl]imino}methyl]phenylalanine (CHEBI:176673) is a phenylalanine derivative (CHEBI:25985)
IUPAC Name
N-[(E)-{[(Z)-2-amino-1,2-dicyanoethenyl]imino}methyl]phenylalanine
Synonym Source
2-[(E)-N'-[(1Z)-2-amino-1,2-dicyanoeth-1-en-1-yl]methanimidamido]-3-phenylpropanoic acid IUPAC
Citation Waiting for Citations Type Source
33479688 PubMed citation SUBMITTER
Last Modified
05 July 2021