(S)-alpha-methyl-4-carboxyphenylglycine
4-[(1S)-1-amino-1-carboxyethyl]benzoic acid
Molecular Identity
(S)-alpha-methyl-4-carboxyphenylglycine
4-[(1S)-1-amino-1-carboxyethyl]benzoic acid
PubChem CID: 446355
(S)-alpha-methyl-4-carboxyphenylglycine is a non-proteinogenic alpha-amino acid that is alanine in which the alpha-hydrogen is replaced by a 4-carboxyphenyl group (the S-enantiomer). It is a non-selective group I/group II metabotropic glutamate receptor (mGluR) antagonist. It has a role as a metabotropic glutamate receptor antagonist.
2D Structure
Properties
C10H11NO4
Molecular Formula
209.20
Molecular Weight
g/mol
209.0688
Exact Mass
Da
-2
XLogP
Drug-like (Lipinski: < 5)
101
TPSA
Good oral absorption (< 140 A²)
3
H-Bond Donors
5
H-Bond Acceptors
271
Complexity
SMILES
Canonical SMILES
SMILES: CC(C1=CC=C(C=C1)C(=O)O)(C(=O)O)NIsomeric SMILES
SMILES: C[C@](C1=CC=C(C=C1)C(=O)O)(C(=O)O)NSynonyms(20)
(S)-MCPG150145-89-4(+)-MCPG4-[(1S)-1-amino-1-carboxyethyl]benzoic acid(S)-ALPHA-METHYL-4-CARBOXYPHENYLGLYCINE(+)-alpha-Methyl-4-carboxyphenylglycine(S)-(ALPHA)-METHYL-4-CARBOXYPHENYLGLYCINE61F6J48NHR(S)-a-methyl-4-carboxyphenylglycine(S)-(+)-alpha-methyl-4-carboxyphenylglycine(S)-(+)-alpha-amino-4-carboxy-2-methylbenzeneaceticalpha-Methyl-4-carboxyphenylglycine, (+)-alpha-Methyl-4-carboxyphenylglycine, (S)-DTXSID2042567CHEBI:43876
Data from PubChem (NCBI)
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Drug Network
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