CHEBI:28044 - phenylalanine

Main ChEBI Ontology Automatic Xrefs
ChEBI Name phenylalanine
ChEBI ID CHEBI:28044
Definition An aromatic amino acid that is alanine in which one of the methyl hydrogens is substituted by a phenyl group.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:8089, CHEBI:25984
Supplier Information
Save molfile Download Molfile
more structures >>
Wikipedia License
Waiting for wikipedia content
Read full article at Wikipedia
Formula C9H11NO2
Net Charge 0
Average Mass 165.18918
InChI InChI=1S/C9H11NO2/c10-8(9(11)12)6-7-4-2-1-3-5-7/h1-5,8H,6,10H2,(H,11,12)
InChIKey COLNVLDHVKWLRT-UHFFFAOYSA-N
SMILES NC(Cc1ccccc1)C(O)=O
Metabolite of Species Details
Daphnia magna (NCBI:35525) See: Mixtures of similarly acting compounds in Daphnia magna: From gene to metabolite and beyondTine Vandenbrouck, Oliver A.H. Jones, Nathalie Dom, Julian L. Griffin, Wim De CoenEnvironment International 36 (2010) 254-268
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
Biological Role(s): Daphnia magna metabolite
A Daphnia metabolite produced by the species Daphnia magna.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing phenylalanine (CHEBI:28044) has part benzyl group (CHEBI:22744)
phenylalanine (CHEBI:28044) has role Daphnia magna metabolite (CHEBI:83056)
phenylalanine (CHEBI:28044) is a α-amino acid (CHEBI:33704)
phenylalanine (CHEBI:28044) is a aromatic amino acid (CHEBI:33856)
phenylalanine (CHEBI:28044) is conjugate acid of phenylalaninate (CHEBI:32504)
phenylalanine (CHEBI:28044) is conjugate base of phenylalaninium (CHEBI:32505)
Incoming γ-Glu-Phe (CHEBI:82966) has functional parent phenylalanine (CHEBI:28044)
4-nitrophenylalanine (CHEBI:48496) has functional parent phenylalanine (CHEBI:28044)
methyl 4-amino-N-(tert-butoxycarbonyl)phenylalaninate (CHEBI:48493) has functional parent phenylalanine (CHEBI:28044)
phenylalanine derivative (CHEBI:25985) has functional parent phenylalanine (CHEBI:28044)
D-phenylalanine (CHEBI:16998) is a phenylalanine (CHEBI:28044)
L-phenylalanine (CHEBI:17295) is a phenylalanine (CHEBI:28044)
phenylalaninium (CHEBI:32505) is conjugate acid of phenylalanine (CHEBI:28044)
phenylalaninate (CHEBI:32504) is conjugate base of phenylalanine (CHEBI:28044)
phenylalanine residue (CHEBI:32503) is substituent group from phenylalanine (CHEBI:28044)
phenylalanino group (CHEBI:25986) is substituent group from phenylalanine (CHEBI:28044)
phenylalanyl group (CHEBI:25987) is substituent group from phenylalanine (CHEBI:28044)
IUPAC Names
2-amino-3-phenylpropanoic acid
phenylalanine
Synonyms Sources
alpha-Amino-beta-phenylpropionic acid KEGG COMPOUND
DL-Phenylalanine KEGG COMPOUND
F ChEBI
fenilalanina ChEBI
PHE ChEBI
Phenylalanin ChEBI
Phenylalanine KEGG COMPOUND
phénylalanine ChEBI
Database Links Databases
C02057 KEGG COMPOUND
Phenylalanine Wikipedia
View more database links
Registry Numbers Types Sources
150-30-1 CAS Registry Number ChemIDplus
150-30-1 CAS Registry Number NIST Chemistry WebBook
1910407 Beilstein Registry Number Beilstein
1910407 Reaxys Registry Number Reaxys
50836 Gmelin Registry Number Gmelin
Citations Waiting for Citations Types Sources
17439666 PubMed citation CiteXplore
22264337 PubMed citation CiteXplore
Last Modified
19 December 2014