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CHEBI:49597 - 3-chloro-L-phenylalanine

Default Structure
ChEBI IDCHEBI:49597
ChEBI Name3-chloro-L-phenylalanine
Stars
ASCII Name3-chloro-L-phenylalanine
DefinitionA non-proteinogenic L-α-amino acid that is L-phenylalanine in which one of the meta-hydrogens of the phenyl group has been replaced by a chlorine.
Secondary ChEBI IDsCHEBI:32489, CHEBI:49596
Last Modified3 December 2015
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC9H10ClNO2
Net Charge0
Average Mass199.637
Monoisotopic Mass199.04001
SMILESN[C@@H](Cc1cccc(Cl)c1)C(=O)O
InChIInChI=1S/C9H10ClNO2/c10-7-3-1-2-6(4-7)5-8(11)9(12)13/h1-4,8H,5,11H2,(H,12,13)/t8-/m0/s1
InChIKeyJJDJLFDGCUYZMN-QMMMGPOBSA-N
Roles Classification
Chemical Roles:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
3-chloro-L-phenylalanine (CHEBI:49597) is a L-phenylalanine derivative (CHEBI:84144)
3-chloro-L-phenylalanine (CHEBI:49597) is a chloroamino acid (CHEBI:23129)
3-chloro-L-phenylalanine (CHEBI:49597) is a monochlorobenzenes (CHEBI:83403)
3-chloro-L-phenylalanine (CHEBI:49597) is a non-proteinogenic L-α-amino acid (CHEBI:83822)
IUPAC Name 
(2S)-2-amino-3-(3-chlorophenyl)propanoic acid
Synonym  Source
3-CHLORO-L-PHENYLALANINEChEBI
Manual XrefsDatabases
FCLPDBeChem
Registry NumbersSources
Beilstein:5523927Beilstein