Basic information
- CAS
14561-55-8- Standard SMILES
C[C@H](C[C@H](N)C(=O)O)C(=O)O- InChIKey
KRKRAOXTGDJWNI-DMTCNVIQSA-N- Molecular formula
- C6H11NO4
- Average molar mass
- 161.16 g/mol
- Monoisotopic mass
- 161.06880783
Overview
(4R)-4-methyl-L-glutamic acid is a 4-methyl-L-glutamic acid in which the methyl group at position 4 adopts R-configuration. It has a role as an excitatory amino acid agonist. It is a conjugate acid of a (4R)-4-methyl-L-glutamate(1-).
Names & identifiers
- Preferred name
- 2S,4R-4-Methylglutamate
- IUPAC
- (2S,4R)-2-amino-4-methylpentanedioic acid
Names & synonyms
(2S,4R)-2-amino-4-methylpentanedioic acid2S,4R-4-MethylglutamateRefChem:484479(2R,4S)-4-amino-4-carboxy-2-methylbutanoate(2S,4R)-4-Methylglutamic acid(4r)-4-methyl-l-glutamic acid77842-39-8PQ76GL74VZ6B8Q87JVZ7CHEMBL2881664-Methyl-L-glutamic acid, (4R)-4-Methyl-DL-glutamic acid, erythro-
Show more names
L-Glutamic acid, 4-methyl-, (4R)-DL-Glutamic acid, 4-methyl-, erythro-(2S,4R)-2-Amino-4-methyl-pentanedioic acid4-Methylglutamatethreo-gamma-Methylglutamate2-Amino-4-methyl-pentanedioic acidSYMNSC 41355
Database identifiers
- CAS
14561-55-8、31137-74-3、77842-39-8- PubChem CID
- 95883
- DTXSID
DTXSID901300044- ChEMBL
CHEMBL288166- ChEBI
CHEBI:228160- UNII
- 6B8Q87JVZ7、PQ76GL74VZ
- Nikkaji
- J686.918A
Properties
Computed structural properties
- XLogP
- -2.9
- Topological polar surface area
- 101 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 168
Experimental & physicochemical properties
DrugsPharmaceuticals -> Listed in ZINC15
Related reactions
1 records
Compound notes
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