Back to Search
Arginine Glutamate
CAS: 4320-30-3 | C11H23N5O6
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
4320-30-3
Molecular Formula:
C11H23N5O6
Molecular Mass:
321.33 g/mol
Names and Synonyms:
Arginine Glutamate
L-Glutamic acid, compd. with L-arginine (1:1)
Glutamic acid, L-, compd. with L-arginine (1:1)
Arginine, L-, salt with L-glutamic acid (1:1)
Arginine, L-, L-glutamate (1:1)
L-Arginine, L-glutamate (1:1)
Arginine glutamate
Modumate
Glutargin
Ginamate
Argimate
Glutepar
Glutamic acid compd. with arginine
NSC 122009
NSC 164937
Identifiers:
SMILES:
N=C(N)NCCC[C@H](N)C(=O)O.N[C@@H](CCC(=O)O)C(=O)O
InChI:
InChI=1S/C6H14N4O2.C5H9NO4/c7-4(5(11)12)2-1-3-10-6(8)9;6-3(5(9)10)1-2-4(7)8/h4H,1-3,7H2,(H,11,12)(H4,8,9,10);3H,1-2,6H2,(H,7,8)(H,9,10)/t4-;3-/m00/s1
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 | 321.33 g/mol | CAS Common Chemistry |
| 321.33400000000006 g/mol | RDKit | |
| 321.16483345599994 g/mol | RDKit | |
| Canonical SMILES | O=C(O)CCC(N)C(=O)O.O=C(O)C(N)CCCNC(=N)N | CAS Common Chemistry |
| InChI | InChI=1S/C6H14N4O2.C5H9NO4/c7-4(5(11)12)2-1-3-10-6(8)9;6-3(5(9)10)1-2-4(7)8/h4H,1-3,7H2,(H,11,12)(H4,8,9,10);3H,1-2,6H2,(H,7,8)(H,9,10)/t4-;3-/m00/s1 | CAS Common Chemistry |
| InChI Key | InChIKey=RVEWUBJVAHOGKA-WOYAITHZSA-N | CAS Common Chemistry |
| Name | Arginine glutamate | CAS Common Chemistry |
| Heavy Atom Count | 22 | RDKit |
| Hydrogen Bond Acceptors | 6 | RDKit |
| Hydrogen Bond Donors | 8 | RDKit |
| Rotatable Bonds | 9 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 225.83999999999997 Ų | RDKit |
| LogP | -2.0753299999999957 | RDKit |
| Molar Refractivity | 77.24300000000002 | RDKit |
