Basic information
- Standard SMILES
NC(=O)C(N)CCC(=O)O- InChIKey
AEFLONBTGZFSGQ-UHFFFAOYSA-N- Molecular formula
- C5H10N2O3
- Average molar mass
- 146.14 g/mol
- Monoisotopic mass
- 146.06914218
Overview
Isoglutamine is a amino acid amide that is glutamic acid in which the carboxy group is replaced by an aminocarbonyl group. It is an amino acid amide and a glutamic acid derivative.
Names & identifiers
- Preferred name
- 4,5-Diamino-5-oxopentanoic acid
- IUPAC
- 4,5-diamino-5-oxopentanoic acid
Names & synonyms
4,5-Diamino-5-oxopentanoic acid328-48-3Pentanoic acid, 4,5-diamino-5-oxo-00VZE9Y4WFISOGLUTAMINE, DL-RefChem:1069369DL-Isoglutaminealpha-glutaminePentanoic acid, 4,5-diamino-5-oxo-, (+-)-617-63-04-aminoglutaramic acidH-Glu-NH
Show more names
H-D-Glu-NHH-Isogln-OH;L-IsoglutamineH-D-Isogln-OH;D-Isoglutamineglutamic acid 1-amideL-Glutamic acid a-amideUNII-00VZE9Y4WF4-amino-4-carbamoylbutyric acid4-amino-4-carbamoylbutanoic acid
Database identifiers
- CAS
328-48-3、617-63-0- PubChem CID
- 164697
- DTXSID
DTXSID80901304- ChEBI
CHEBI:21305- UNII
- 00VZE9Y4WF
- Nikkaji
- J1.199A
Properties
Computed structural properties
- XLogP
- -4.3
- Topological polar surface area
- 106 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 146
Related reactions
0 records
No reaction records under the current filter.
Linked notes
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