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Glutamine
CAS: 56-85-9 | C5H10N2O3
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
56-85-9
Molecular Formula:
C5H10N2O3
Molecular Mass:
146.15 g/mol
Names and Synonyms:
Glutamine
L-Glutamine
Glutamine, L-
Glutamic acid amide
Glutamic acid 5-amide
Glumin
Glutamine
Pentanoic acid, 2,5-diamino-5-oxo-, (S)-
L-Glutamic acid γ-amide
γ-Glutamine
2-Aminoglutaramic acid
L-2-Aminoglutaramidic acid
Cebrogen
Stimulina
(S)-2,5-Diamino-5-oxopentanoic acid
L-(+)-Glutamine
Levoglutamide
Glumin (amino acid)
NSC 27421
Aesgen 14
Acustasin
Saforis
Endari
(2S)-2-Amino-4-carbamoylbutanoic acid
(2S)-2,5-Diamino-5-oxopentanoic acid
12: PN: WO2021055880 SEQID: 13 claimed protein
Identifiers:
SMILES:
N=C(O)CC[C@H](N)C(=O)O
InChI:
InChI=1S/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1
Key Properties
Melting Point
185.5 °C (decomp)
CAS Common Chemistry
Spectral Data
NMR, IR, and Mass spectral data
1H NMR
13C NMR
Predicting NMR spectra...
10 ppm
9
8
7
6
5
4
3
2
1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
160
140
120
100
80
60
40
20
0 ppm
| Shift (ppm) | DEPT | Assignment |
|---|
Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 146.15 g/mol | CAS Common Chemistry |
| 146.14600000000002 g/mol | RDKit | |
| 146.06914218 g/mol | RDKit | |
| Wikipedia Url | https://en.wikipedia.org/wiki/Glutamine | CAS Common Chemistry |
| Canonical SMILES | O=C(O)C(N)CCC(=O)N | CAS Common Chemistry |
| InChI | InChI=1S/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1 | CAS Common Chemistry |
| InChI Key | InChIKey=ZDXPYRJPNDTMRX-VKHMYHEASA-N | CAS Common Chemistry |
| Melting Point | 185.5 °C (decomp) | CAS Common Chemistry |
| Name | L-Glutamine | CAS Common Chemistry |
| Glutamine | CAS Common Chemistry | |
| Heavy Atom Count | 10 | RDKit |
| Hydrogen Bond Acceptors | 3 | RDKit |
| Hydrogen Bond Donors | 4 | RDKit |
| Rotatable Bonds | 4 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 107.39999999999999 Ų | RDKit |
| LogP | -0.28623000000000004 | RDKit |
| Molar Refractivity | 35.20069999999999 | RDKit |
