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Record Information

Version

5.0

Status

Expected but not Quantified

Creation Date

2006-05-22 14:17:44 UTC

Update Date

2021-09-14 15:46:17 UTC

HMDB ID

HMDB0002248

Secondary Accession Numbers

HMDB02248

Metabolite Identification

Common Name

Gamma glutamyl ornithine

Description

Gamma glutamyl ornithine is found in human urine. - PubMed reference: 1148212. Gamma-glutamylornithine has been identified in urine from patients with the HHH syndrome (hyperornithinemia, hyperammonemia and homocitrullinuria) and with gyrate atrophy associated with hyperornithinemia. The amount of gamma-glutamylornithine excreted was 10-15 times higher than that excreted in normal subjects. - PubMed reference: 6547887.

Structure

MOL 3D MOL SDF 3D SDF PDB 3D PDB SMILES InChI

HMDB0002248
     RDKit          3D
Gamma glutamyl ornithine
 37 36  0  0  0  0  0  0  0  0999 V2000
   -4.0338    2.3255    0.2984 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0484    1.1437    1.1768 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7579    0.3591    1.0172 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5624   -0.1044   -0.4017 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2679   -0.8740   -0.4943 C   0  0  2  0  0  0  0  0  0  0  0  0
   -0.1373   -0.0432   -0.1024 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.7526   -0.4548    0.9096 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5662   -1.5461    1.4785 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9015    0.4162    1.2845 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.6915   -0.2204    2.3326 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.7473    0.7228    0.0944 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3492   -0.4923   -0.5702 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1399   -0.0328   -1.7375 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6212    0.7246   -2.6049 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.4439   -0.4250   -1.8819 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9977   -1.2702   -1.9149 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0023   -0.9278   -2.5595 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9522   -2.0792   -2.5169 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7493    3.0180    0.5369 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1209    2.0169   -0.7022 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2270    1.4842    2.2057 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9387    0.5570    0.8789 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9222    0.9963    1.3760 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8470   -0.5322    1.6644 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4056   -0.8147   -0.6291 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5407    0.7493   -1.1219 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2777   -1.7970    0.0856 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0300    0.8678   -0.6145 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5022    1.3601    1.7354 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3017   -0.9872    1.9871 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0521   -0.6595    3.0544 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1282    1.2772   -0.6669 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5829    1.4206    0.3814 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0228   -1.0549    0.0957 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5126   -1.1158   -0.9679 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.8855   -1.2006   -1.4127 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3823   -2.8074   -1.9460 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  2  0
  7  9  1  0
  9 10  1  0
  9 11  1  0
 11 12  1  0
 12 13  1  0
 13 14  2  0
 13 15  1  0
  5 16  1  0
 16 17  2  0
 16 18  1  0
  1 19  1  0
  1 20  1  0
  2 21  1  0
  2 22  1  0
  3 23  1  0
  3 24  1  0
  4 25  1  0
  4 26  1  0
  5 27  1  1
  6 28  1  0
  9 29  1  1
 10 30  1  0
 10 31  1  0
 11 32  1  0
 11 33  1  0
 12 34  1  0
 12 35  1  0
 15 36  1  0
 18 37  1  0
M  END

Decanoylcarnitine.mol
  Mrv1652304202019292D          

 18 17  0  0  0  0            999 V2000
    0.4125   -2.1434    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4125   -0.7145    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -1.4289    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.8250   -1.4289    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2375   -0.7145    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0625   -0.7145    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4750    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -2.8579    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2375   -2.1434    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2375   -0.7145    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4750    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.6500    0.0000    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.2375    0.7145    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6500    1.4289    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2375    2.1434    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4125    2.1434    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6500    2.8579    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6500   -1.4289    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  3  2  1  6  0  0  0
  1  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  1  8  2  0  0  0  0
  1  9  1  0  0  0  0
 12 11  1  6  0  0  0
 10 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
 15 17  1  0  0  0  0
 10 18  2  0  0  0  0
  2 10  1  0  0  0  0
M  END
> <DATABASE_ID>
HMDB0002248

> <DATABASE_NAME>
hmdb

> <SMILES>
NCCC[C@H](NC(=O)[C@@H](N)CCC(O)=O)C(O)=O

> <INCHI_IDENTIFIER>
InChI=1S/C10H19N3O5/c11-5-1-2-7(10(17)18)13-9(16)6(12)3-4-8(14)15/h6-7H,1-5,11-12H2,(H,13,16)(H,14,15)(H,17,18)/t6-,7-/m0/s1

> <INCHI_KEY>
FCQBDQYWNGUTPD-BQBZGAKWSA-N

> <FORMULA>
C10H19N3O5

> <MOLECULAR_WEIGHT>
261.275

> <EXACT_MASS>
261.132470733

> <JCHEM_ACCEPTOR_COUNT>
7

> <JCHEM_ATOM_COUNT>
37

> <JCHEM_AVERAGE_POLARIZABILITY>
26.21763358468728

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
5

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
(2S)-5-amino-2-[(2S)-2-amino-4-carboxybutanamido]pentanoic acid

> <ALOGPS_LOGP>
-3.98

> <JCHEM_LOGP>
-6.572133697332091

> <ALOGPS_LOGS>
-1.45

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA>
4.020533935071865

> <JCHEM_PKA_STRONGEST_ACIDIC>
3.287712125793635

> <JCHEM_PKA_STRONGEST_BASIC>
9.919124833610233

> <JCHEM_POLAR_SURFACE_AREA>
155.73999999999998

> <JCHEM_REFRACTIVITY>
61.29630000000001

> <JCHEM_ROTATABLE_BOND_COUNT>
9

> <JCHEM_RULE_OF_FIVE>
1

> <ALOGPS_SOLUBILITY>
9.34e+00 g/l

> <JCHEM_TRADITIONAL_IUPAC>
(2S)-5-amino-2-[(2S)-2-amino-4-carboxybutanamido]pentanoic acid

> <JCHEM_VEBER_RULE>
0

$$$$

HMDB0002248
     RDKit          3D
Gamma glutamyl ornithine
 37 36  0  0  0  0  0  0  0  0999 V2000
   -4.0338    2.3255    0.2984 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0484    1.1437    1.1768 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7579    0.3591    1.0172 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5624   -0.1044   -0.4017 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2679   -0.8740   -0.4943 C   0  0  2  0  0  0  0  0  0  0  0  0
   -0.1373   -0.0432   -0.1024 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.7526   -0.4548    0.9096 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5662   -1.5461    1.4785 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9015    0.4162    1.2845 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.6915   -0.2204    2.3326 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.7473    0.7228    0.0944 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3492   -0.4923   -0.5702 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1399   -0.0328   -1.7375 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6212    0.7246   -2.6049 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.4439   -0.4250   -1.8819 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9977   -1.2702   -1.9149 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0023   -0.9278   -2.5595 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9522   -2.0792   -2.5169 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7493    3.0180    0.5369 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1209    2.0169   -0.7022 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2270    1.4842    2.2057 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9387    0.5570    0.8789 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9222    0.9963    1.3760 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8470   -0.5322    1.6644 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4056   -0.8147   -0.6291 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5407    0.7493   -1.1219 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2777   -1.7970    0.0856 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0300    0.8678   -0.6145 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5022    1.3601    1.7354 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3017   -0.9872    1.9871 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0521   -0.6595    3.0544 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1282    1.2772   -0.6669 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5829    1.4206    0.3814 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0228   -1.0549    0.0957 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5126   -1.1158   -0.9679 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.8855   -1.2006   -1.4127 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3823   -2.8074   -1.9460 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  2  0
  7  9  1  0
  9 10  1  0
  9 11  1  0
 11 12  1  0
 12 13  1  0
 13 14  2  0
 13 15  1  0
  5 16  1  0
 16 17  2  0
 16 18  1  0
  1 19  1  0
  1 20  1  0
  2 21  1  0
  2 22  1  0
  3 23  1  0
  3 24  1  0
  4 25  1  0
  4 26  1  0
  5 27  1  1
  6 28  1  0
  9 29  1  1
 10 30  1  0
 10 31  1  0
 11 32  1  0
 11 33  1  0
 12 34  1  0
 12 35  1  0
 15 36  1  0
 18 37  1  0
M  END

HEADER    PROTEIN                                 20-APR-20   NONE
TITLE     NULL                                                        
COMPND    MOLECULE: Decanoylcarnitine.mol                             
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   20-APR-20         0                                  
HETATM    1  C   UNK     0       0.770  -4.001   0.000  0.00  0.00           C+0
HETATM    2  N   UNK     0       0.770  -1.334   0.000  0.00  0.00           N+0
HETATM    3  C   UNK     0       0.000  -2.667   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0      -1.540  -2.667   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0      -2.310  -1.334   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0      -3.850  -1.334   0.000  0.00  0.00           C+0
HETATM    7  N   UNK     0      -4.620   0.000   0.000  0.00  0.00           N+0
HETATM    8  O   UNK     0       0.000  -5.335   0.000  0.00  0.00           O+0
HETATM    9  O   UNK     0       2.310  -4.001   0.000  0.00  0.00           O+0
HETATM   10  C   UNK     0       2.310  -1.334   0.000  0.00  0.00           C+0
HETATM   11  N   UNK     0       4.620   0.000   0.000  0.00  0.00           N+0
HETATM   12  C   UNK     0       3.080   0.000   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0       2.310   1.334   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0       3.080   2.667   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0       2.310   4.001   0.000  0.00  0.00           C+0
HETATM   16  O   UNK     0       0.770   4.001   0.000  0.00  0.00           O+0
HETATM   17  O   UNK     0       3.080   5.335   0.000  0.00  0.00           O+0
HETATM   18  O   UNK     0       3.080  -2.667   0.000  0.00  0.00           O+0
CONECT    1    3    8    9                                                  
CONECT    2    3   10                                                       
CONECT    3    2    1    4                                                  
CONECT    4    3    5                                                       
CONECT    5    4    6                                                       
CONECT    6    5    7                                                       
CONECT    7    6                                                            
CONECT    8    1                                                            
CONECT    9    1                                                            
CONECT   10   12   18    2                                                  
CONECT   11   12                                                            
CONECT   12   11   10   13                                                  
CONECT   13   12   14                                                       
CONECT   14   13   15                                                       
CONECT   15   14   16   17                                                  
CONECT   16   15                                                            
CONECT   17   15                                                            
CONECT   18   10                                                            
MASTER        0    0    0    0    0    0    0    0   18    0   34    0
END

COMPND    HMDB0002248
HETATM    1  N1  UNL     1      -4.034   2.325   0.298  1.00  0.00           N  
HETATM    2  C1  UNL     1      -4.048   1.144   1.177  1.00  0.00           C  
HETATM    3  C2  UNL     1      -2.758   0.359   1.017  1.00  0.00           C  
HETATM    4  C3  UNL     1      -2.562  -0.104  -0.402  1.00  0.00           C  
HETATM    5  C4  UNL     1      -1.268  -0.874  -0.494  1.00  0.00           C  
HETATM    6  N2  UNL     1      -0.137  -0.043  -0.102  1.00  0.00           N  
HETATM    7  C5  UNL     1       0.753  -0.455   0.910  1.00  0.00           C  
HETATM    8  O1  UNL     1       0.566  -1.546   1.479  1.00  0.00           O  
HETATM    9  C6  UNL     1       1.901   0.416   1.285  1.00  0.00           C  
HETATM   10  N3  UNL     1       2.691  -0.220   2.333  1.00  0.00           N  
HETATM   11  C7  UNL     1       2.747   0.723   0.094  1.00  0.00           C  
HETATM   12  C8  UNL     1       3.349  -0.492  -0.570  1.00  0.00           C  
HETATM   13  C9  UNL     1       4.140  -0.033  -1.737  1.00  0.00           C  
HETATM   14  O2  UNL     1       3.621   0.725  -2.605  1.00  0.00           O  
HETATM   15  O3  UNL     1       5.444  -0.425  -1.882  1.00  0.00           O  
HETATM   16  C10 UNL     1      -0.998  -1.270  -1.915  1.00  0.00           C  
HETATM   17  O4  UNL     1      -0.002  -0.928  -2.560  1.00  0.00           O  
HETATM   18  O5  UNL     1      -1.952  -2.079  -2.517  1.00  0.00           O  
HETATM   19  H1  UNL     1      -4.749   3.018   0.537  1.00  0.00           H  
HETATM   20  H2  UNL     1      -4.121   2.017  -0.702  1.00  0.00           H  
HETATM   21  H3  UNL     1      -4.227   1.484   2.206  1.00  0.00           H  
HETATM   22  H4  UNL     1      -4.939   0.557   0.879  1.00  0.00           H  
HETATM   23  H5  UNL     1      -1.922   0.996   1.376  1.00  0.00           H  
HETATM   24  H6  UNL     1      -2.847  -0.532   1.664  1.00  0.00           H  
HETATM   25  H7  UNL     1      -3.406  -0.815  -0.629  1.00  0.00           H  
HETATM   26  H8  UNL     1      -2.541   0.749  -1.122  1.00  0.00           H  
HETATM   27  H9  UNL     1      -1.278  -1.797   0.086  1.00  0.00           H  
HETATM   28  H10 UNL     1      -0.030   0.868  -0.614  1.00  0.00           H  
HETATM   29  H11 UNL     1       1.502   1.360   1.735  1.00  0.00           H  
HETATM   30  H12 UNL     1       3.302  -0.987   1.987  1.00  0.00           H  
HETATM   31  H13 UNL     1       2.052  -0.660   3.054  1.00  0.00           H  
HETATM   32  H14 UNL     1       2.128   1.277  -0.667  1.00  0.00           H  
HETATM   33  H15 UNL     1       3.583   1.421   0.381  1.00  0.00           H  
HETATM   34  H16 UNL     1       4.023  -1.055   0.096  1.00  0.00           H  
HETATM   35  H17 UNL     1       2.513  -1.116  -0.968  1.00  0.00           H  
HETATM   36  H18 UNL     1       5.886  -1.201  -1.413  1.00  0.00           H  
HETATM   37  H19 UNL     1      -2.382  -2.807  -1.946  1.00  0.00           H  
CONECT    1    2   19   20
CONECT    2    3   21   22
CONECT    3    4   23   24
CONECT    4    5   25   26
CONECT    5    6   16   27
CONECT    6    7   28
CONECT    7    8    8    9
CONECT    9   10   11   29
CONECT   10   30   31
CONECT   11   12   32   33
CONECT   12   13   34   35
CONECT   13   14   14   15
CONECT   15   36
CONECT   16   17   17   18
CONECT   18   37
END

HMDB0002248
     RDKit          3D
Gamma glutamyl ornithine
 37 36  0  0  0  0  0  0  0  0999 V2000
   -4.0338    2.3255    0.2984 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0484    1.1437    1.1768 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7579    0.3591    1.0172 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5624   -0.1044   -0.4017 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2679   -0.8740   -0.4943 C   0  0  2  0  0  0  0  0  0  0  0  0
   -0.1373   -0.0432   -0.1024 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.7526   -0.4548    0.9096 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5662   -1.5461    1.4785 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9015    0.4162    1.2845 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.6915   -0.2204    2.3326 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.7473    0.7228    0.0944 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3492   -0.4923   -0.5702 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1399   -0.0328   -1.7375 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6212    0.7246   -2.6049 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.4439   -0.4250   -1.8819 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9977   -1.2702   -1.9149 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0023   -0.9278   -2.5595 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9522   -2.0792   -2.5169 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7493    3.0180    0.5369 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1209    2.0169   -0.7022 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2270    1.4842    2.2057 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9387    0.5570    0.8789 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9222    0.9963    1.3760 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8470   -0.5322    1.6644 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4056   -0.8147   -0.6291 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5407    0.7493   -1.1219 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2777   -1.7970    0.0856 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0300    0.8678   -0.6145 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5022    1.3601    1.7354 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3017   -0.9872    1.9871 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0521   -0.6595    3.0544 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1282    1.2772   -0.6669 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5829    1.4206    0.3814 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0228   -1.0549    0.0957 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5126   -1.1158   -0.9679 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.8855   -1.2006   -1.4127 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3823   -2.8074   -1.9460 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  2  0
  7  9  1  0
  9 10  1  0
  9 11  1  0
 11 12  1  0
 12 13  1  0
 13 14  2  0
 13 15  1  0
  5 16  1  0
 16 17  2  0
 16 18  1  0
  1 19  1  0
  1 20  1  0
  2 21  1  0
  2 22  1  0
  3 23  1  0
  3 24  1  0
  4 25  1  0
  4 26  1  0
  5 27  1  1
  6 28  1  0
  9 29  1  1
 10 30  1  0
 10 31  1  0
 11 32  1  0
 11 33  1  0
 12 34  1  0
 12 35  1  0
 15 36  1  0
 18 37  1  0
M  END

View in JSmol View NMR Assignments View Stereo Labels

Synonyms

Value	Source
g Glutamyl ornithine	Generator
Γ glutamyl ornithine	Generator
gamma-Glutamylornithine	HMDB
L-gamma-Glutamyl-L-ornithine	HMDB
gamma-Glu-orn	HMDB
(4S)-4-Amino-4-{[(1S)-4-amino-1-carboxybutyl]-C-hydroxycarbonimidoyl}butanoate	HMDB
g-Glutamylornithine	HMDB
Γ-glutamylornithine	HMDB

Chemical Formula

C₁₀H₁₉N₃O₅

Average Molecular Weight

261.275

Monoisotopic Molecular Weight

261.132470733

IUPAC Name

(2S)-5-amino-2-[(2S)-2-amino-4-carboxybutanamido]pentanoic acid

Traditional Name

(2S)-5-amino-2-[(2S)-2-amino-4-carboxybutanamido]pentanoic acid

CAS Registry Number

56523-61-6

SMILES

NCCC[C@H](NC(=O)[C@@H](N)CCC(O)=O)C(O)=O

InChI Identifier

InChI=1S/C10H19N3O5/c11-5-1-2-7(10(17)18)13-9(16)6(12)3-4-8(14)15/h6-7H,1-5,11-12H2,(H,13,16)(H,14,15)(H,17,18)/t6-,7-/m0/s1

InChI Key

FCQBDQYWNGUTPD-BQBZGAKWSA-N

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as dipeptides. These are organic compounds containing a sequence of exactly two alpha-amino acids joined by a peptide bond.

Kingdom

Organic compounds

Super Class

Organic acids and derivatives

Class

Carboxylic acids and derivatives

Sub Class

Amino acids, peptides, and analogues

Direct Parent

Dipeptides

Alternative Parents

Substituents

Alpha-dipeptide
Glutamic acid or derivatives
N-acyl-alpha-amino acid
N-acyl-alpha amino acid or derivatives
N-acyl-l-alpha-amino acid
Alpha-amino acid amide
Alpha-amino acid or derivatives
Amino fatty acid
Fatty acyl
Fatty acid
Dicarboxylic acid or derivatives
Fatty amide
N-acyl-amine
Amino acid
Secondary carboxylic acid amide
Amino acid or derivatives
Carboxamide group
Carboxylic acid
Organic nitrogen compound
Primary aliphatic amine
Organonitrogen compound
Organooxygen compound
Primary amine
Hydrocarbon derivative
Carbonyl group
Organic oxide
Organopnictogen compound
Amine
Organic oxygen compound
Aliphatic acyclic compound

Molecular Framework

Aliphatic acyclic compounds

External Descriptors

Not Available

Ontology

Not Available

Endogenous (HMDB: HMDB0002248)

Pheasant (FooDB: FOOD00430)
Squab (FooDB: FOOD00481)
Turkey (FooDB: FOOD00494)
Quail (FooDB: FOOD00541)
Anatidae (FooDB: FOOD00576)
Rock ptarmigan (FooDB: FOOD00597)
Columbidae (Dove, Pigeon) (FooDB: FOOD00610)
Chicken (FooDB: FOOD00329)
Mallard duck (FooDB: FOOD00353)
Emu (FooDB: FOOD00360)
Greylag goose (FooDB: FOOD00368)
Guinea hen (FooDB: FOOD00373)
Ostrich (FooDB: FOOD00422)
Velvet duck (FooDB: FOOD00427)

Lagomorph

Ovis

Sheep (Mutton, Lamb) (FooDB: FOOD00473)

Bovine

Venison

Deer (FooDB: FOOD00524)
Mule deer (FooDB: FOOD00348)
Elk (FooDB: FOOD00359)

Caprae

Domestic goat (FooDB: FOOD00529)

Swine

Domestic pig (FooDB: FOOD00536)
Wild boar (FooDB: FOOD00307)

Equine

Horse (FooDB: FOOD00378)

Process

Not Available

Role

Not Available

Physical Properties

State

Solid

Experimental Molecular Properties

Property	Value	Reference
Melting Point	209 °C	Not Available
Boiling Point	Not Available	Not Available
Water Solubility	Not Available	Not Available
LogP	Not Available	Not Available

Experimental Chromatographic Properties

Not Available

Predicted Molecular Properties

Property	Value	Source
Water Solubility	9.34 g/L	ALOGPS
logP	-4	ALOGPS
logP	-6.6	ChemAxon
logS	-1.4	ALOGPS
pKa (Strongest Acidic)	3.29	ChemAxon
pKa (Strongest Basic)	9.92	ChemAxon
Physiological Charge	0	ChemAxon
Hydrogen Acceptor Count	7	ChemAxon
Hydrogen Donor Count	5	ChemAxon
Polar Surface Area	155.74 Å²	ChemAxon
Rotatable Bond Count	9	ChemAxon
Refractivity	61.3 m³·mol⁻¹	ChemAxon
Polarizability	26.22 Å³	ChemAxon
Number of Rings	0	ChemAxon
Bioavailability	Yes	ChemAxon
Rule of Five	Yes	ChemAxon
Ghose Filter	No	ChemAxon
Veber's Rule	No	ChemAxon
MDDR-like Rule	No	ChemAxon

Predicted Chromatographic Properties

Predicted Collision Cross Sections

Predictor	Adduct Type	CCS Value (Å²)	Reference
DarkChem	[M+H]+	160.736	31661259
DarkChem	[M-H]-	158.381	31661259
DeepCCS	[M+H]+	166.47	30932474
DeepCCS	[M-H]-	164.112	30932474
DeepCCS	[M-2H]-	196.999	30932474
DeepCCS	[M+Na]+	172.563	30932474
AllCCS	[M+H]+	156.4	32859911
AllCCS	[M+H-H2O]+	153.4	32859911
AllCCS	[M+NH4]+	159.2	32859911
AllCCS	[M+Na]+	160.0	32859911
AllCCS	[M-H]-	158.7	32859911
AllCCS	[M+Na-2H]-	159.1	32859911
AllCCS	[M+HCOO]-	159.5	32859911

Predicted Kovats Retention Indices

Underivatized

Metabolite	SMILES	Kovats RI Value	Column Type	Reference
Gamma glutamyl ornithine	NCCC[C@H](NC(=O)[C@@H](N)CCC(O)=O)C(O)=O	3416.6	Standard polar	33892256
Gamma glutamyl ornithine	NCCC[C@H](NC(=O)[C@@H](N)CCC(O)=O)C(O)=O	2332.0	Standard non polar	33892256
Gamma glutamyl ornithine	NCCC[C@H](NC(=O)[C@@H](N)CCC(O)=O)C(O)=O	2494.0	Semi standard non polar	33892256

Derivatized

Derivative Name / Structure	SMILES	Kovats RI Value	Column Type	Reference
Gamma glutamyl ornithine,1TMS,isomer #1	C[Si](C)(C)OC(=O)CC[C@H](N)C(=O)N[C@@H](CCCN)C(=O)O	2397.0	Semi standard non polar	33892256
Gamma glutamyl ornithine,1TMS,isomer #2	C[Si](C)(C)OC(=O)[C@H](CCCN)NC(=O)[C@@H](N)CCC(=O)O	2380.8	Semi standard non polar	33892256
Gamma glutamyl ornithine,1TMS,isomer #3	C[Si](C)(C)NCCC[C@H](NC(=O)[C@@H](N)CCC(=O)O)C(=O)O	2545.8	Semi standard non polar	33892256
Gamma glutamyl ornithine,1TMS,isomer #4	C[Si](C)(C)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCN)C(=O)O	2472.7	Semi standard non polar	33892256
Gamma glutamyl ornithine,1TMS,isomer #5	C[Si](C)(C)N(C(=O)[C@@H](N)CCC(=O)O)[C@@H](CCCN)C(=O)O	2375.3	Semi standard non polar	33892256
Gamma glutamyl ornithine,2TMS,isomer #1	C[Si](C)(C)OC(=O)CC[C@H](N)C(=O)N[C@@H](CCCN)C(=O)O[Si](C)(C)C	2418.6	Semi standard non polar	33892256
Gamma glutamyl ornithine,2TMS,isomer #10	C[Si](C)(C)NCCC[C@@H](C(=O)O)N(C(=O)[C@@H](N)CCC(=O)O)[Si](C)(C)C	2514.7	Semi standard non polar	33892256
Gamma glutamyl ornithine,2TMS,isomer #11	C[Si](C)(C)N([C@@H](CCC(=O)O)C(=O)N[C@@H](CCCN)C(=O)O)[Si](C)(C)C	2602.3	Semi standard non polar	33892256
Gamma glutamyl ornithine,2TMS,isomer #12	C[Si](C)(C)N[C@@H](CCC(=O)O)C(=O)N([C@@H](CCCN)C(=O)O)[Si](C)(C)C	2440.2	Semi standard non polar	33892256
Gamma glutamyl ornithine,2TMS,isomer #2	C[Si](C)(C)N[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)N[C@@H](CCCN)C(=O)O	2451.0	Semi standard non polar	33892256
Gamma glutamyl ornithine,2TMS,isomer #3	C[Si](C)(C)NCCC[C@H](NC(=O)[C@@H](N)CCC(=O)O[Si](C)(C)C)C(=O)O	2540.9	Semi standard non polar	33892256
Gamma glutamyl ornithine,2TMS,isomer #4	C[Si](C)(C)OC(=O)CC[C@H](N)C(=O)N([C@@H](CCCN)C(=O)O)[Si](C)(C)C	2355.6	Semi standard non polar	33892256
Gamma glutamyl ornithine,2TMS,isomer #5	C[Si](C)(C)NCCC[C@H](NC(=O)[C@@H](N)CCC(=O)O)C(=O)O[Si](C)(C)C	2531.1	Semi standard non polar	33892256
Gamma glutamyl ornithine,2TMS,isomer #6	C[Si](C)(C)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCN)C(=O)O[Si](C)(C)C	2457.0	Semi standard non polar	33892256
Gamma glutamyl ornithine,2TMS,isomer #7	C[Si](C)(C)OC(=O)[C@H](CCCN)N(C(=O)[C@@H](N)CCC(=O)O)[Si](C)(C)C	2359.7	Semi standard non polar	33892256
Gamma glutamyl ornithine,2TMS,isomer #8	C[Si](C)(C)NCCC[C@H](NC(=O)[C@H](CCC(=O)O)N[Si](C)(C)C)C(=O)O	2604.5	Semi standard non polar	33892256
Gamma glutamyl ornithine,2TMS,isomer #9	C[Si](C)(C)N(CCC[C@H](NC(=O)[C@@H](N)CCC(=O)O)C(=O)O)[Si](C)(C)C	2697.1	Semi standard non polar	33892256
Gamma glutamyl ornithine,3TMS,isomer #1	C[Si](C)(C)N[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)N[C@@H](CCCN)C(=O)O[Si](C)(C)C	2462.8	Semi standard non polar	33892256
Gamma glutamyl ornithine,3TMS,isomer #1	C[Si](C)(C)N[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)N[C@@H](CCCN)C(=O)O[Si](C)(C)C	2456.7	Standard non polar	33892256
Gamma glutamyl ornithine,3TMS,isomer #1	C[Si](C)(C)N[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)N[C@@H](CCCN)C(=O)O[Si](C)(C)C	3885.2	Standard polar	33892256
Gamma glutamyl ornithine,3TMS,isomer #10	C[Si](C)(C)OC(=O)[C@H](CCCN([Si](C)(C)C)[Si](C)(C)C)NC(=O)[C@@H](N)CCC(=O)O	2695.2	Semi standard non polar	33892256
Gamma glutamyl ornithine,3TMS,isomer #10	C[Si](C)(C)OC(=O)[C@H](CCCN([Si](C)(C)C)[Si](C)(C)C)NC(=O)[C@@H](N)CCC(=O)O	2509.2	Standard non polar	33892256
Gamma glutamyl ornithine,3TMS,isomer #10	C[Si](C)(C)OC(=O)[C@H](CCCN([Si](C)(C)C)[Si](C)(C)C)NC(=O)[C@@H](N)CCC(=O)O	4164.7	Standard polar	33892256
Gamma glutamyl ornithine,3TMS,isomer #11	C[Si](C)(C)NCCC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)[C@@H](N)CCC(=O)O)[Si](C)(C)C	2476.2	Semi standard non polar	33892256
Gamma glutamyl ornithine,3TMS,isomer #11	C[Si](C)(C)NCCC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)[C@@H](N)CCC(=O)O)[Si](C)(C)C	2481.5	Standard non polar	33892256
Gamma glutamyl ornithine,3TMS,isomer #11	C[Si](C)(C)NCCC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)[C@@H](N)CCC(=O)O)[Si](C)(C)C	3827.2	Standard polar	33892256
Gamma glutamyl ornithine,3TMS,isomer #12	C[Si](C)(C)OC(=O)[C@H](CCCN)NC(=O)[C@H](CCC(=O)O)N([Si](C)(C)C)[Si](C)(C)C	2588.4	Semi standard non polar	33892256
Gamma glutamyl ornithine,3TMS,isomer #12	C[Si](C)(C)OC(=O)[C@H](CCCN)NC(=O)[C@H](CCC(=O)O)N([Si](C)(C)C)[Si](C)(C)C	2517.4	Standard non polar	33892256
Gamma glutamyl ornithine,3TMS,isomer #12	C[Si](C)(C)OC(=O)[C@H](CCCN)NC(=O)[C@H](CCC(=O)O)N([Si](C)(C)C)[Si](C)(C)C	3890.8	Standard polar	33892256
Gamma glutamyl ornithine,3TMS,isomer #13	C[Si](C)(C)N[C@@H](CCC(=O)O)C(=O)N([C@@H](CCCN)C(=O)O[Si](C)(C)C)[Si](C)(C)C	2429.3	Semi standard non polar	33892256
Gamma glutamyl ornithine,3TMS,isomer #13	C[Si](C)(C)N[C@@H](CCC(=O)O)C(=O)N([C@@H](CCCN)C(=O)O[Si](C)(C)C)[Si](C)(C)C	2446.2	Standard non polar	33892256
Gamma glutamyl ornithine,3TMS,isomer #13	C[Si](C)(C)N[C@@H](CCC(=O)O)C(=O)N([C@@H](CCCN)C(=O)O[Si](C)(C)C)[Si](C)(C)C	3774.3	Standard polar	33892256
Gamma glutamyl ornithine,3TMS,isomer #14	C[Si](C)(C)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCN([Si](C)(C)C)[Si](C)(C)C)C(=O)O	2749.0	Semi standard non polar	33892256
Gamma glutamyl ornithine,3TMS,isomer #14	C[Si](C)(C)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCN([Si](C)(C)C)[Si](C)(C)C)C(=O)O	2604.9	Standard non polar	33892256
Gamma glutamyl ornithine,3TMS,isomer #14	C[Si](C)(C)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCN([Si](C)(C)C)[Si](C)(C)C)C(=O)O	3728.1	Standard polar	33892256
Gamma glutamyl ornithine,3TMS,isomer #15	C[Si](C)(C)NCCC[C@@H](C(=O)O)N(C(=O)[C@H](CCC(=O)O)N[Si](C)(C)C)[Si](C)(C)C	2548.4	Semi standard non polar	33892256
Gamma glutamyl ornithine,3TMS,isomer #15	C[Si](C)(C)NCCC[C@@H](C(=O)O)N(C(=O)[C@H](CCC(=O)O)N[Si](C)(C)C)[Si](C)(C)C	2588.1	Standard non polar	33892256
Gamma glutamyl ornithine,3TMS,isomer #15	C[Si](C)(C)NCCC[C@@H](C(=O)O)N(C(=O)[C@H](CCC(=O)O)N[Si](C)(C)C)[Si](C)(C)C	3511.6	Standard polar	33892256
Gamma glutamyl ornithine,3TMS,isomer #16	C[Si](C)(C)NCCC[C@H](NC(=O)[C@H](CCC(=O)O)N([Si](C)(C)C)[Si](C)(C)C)C(=O)O	2723.1	Semi standard non polar	33892256
Gamma glutamyl ornithine,3TMS,isomer #16	C[Si](C)(C)NCCC[C@H](NC(=O)[C@H](CCC(=O)O)N([Si](C)(C)C)[Si](C)(C)C)C(=O)O	2630.3	Standard non polar	33892256
Gamma glutamyl ornithine,3TMS,isomer #16	C[Si](C)(C)NCCC[C@H](NC(=O)[C@H](CCC(=O)O)N([Si](C)(C)C)[Si](C)(C)C)C(=O)O	3667.0	Standard polar	33892256
Gamma glutamyl ornithine,3TMS,isomer #17	C[Si](C)(C)N(C(=O)[C@@H](N)CCC(=O)O)[C@@H](CCCN([Si](C)(C)C)[Si](C)(C)C)C(=O)O	2657.8	Semi standard non polar	33892256
Gamma glutamyl ornithine,3TMS,isomer #17	C[Si](C)(C)N(C(=O)[C@@H](N)CCC(=O)O)[C@@H](CCCN([Si](C)(C)C)[Si](C)(C)C)C(=O)O	2558.4	Standard non polar	33892256
Gamma glutamyl ornithine,3TMS,isomer #17	C[Si](C)(C)N(C(=O)[C@@H](N)CCC(=O)O)[C@@H](CCCN([Si](C)(C)C)[Si](C)(C)C)C(=O)O	3942.2	Standard polar	33892256
Gamma glutamyl ornithine,3TMS,isomer #18	C[Si](C)(C)N(C(=O)[C@H](CCC(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[C@@H](CCCN)C(=O)O	2560.4	Semi standard non polar	33892256
Gamma glutamyl ornithine,3TMS,isomer #18	C[Si](C)(C)N(C(=O)[C@H](CCC(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[C@@H](CCCN)C(=O)O	2522.4	Standard non polar	33892256
Gamma glutamyl ornithine,3TMS,isomer #18	C[Si](C)(C)N(C(=O)[C@H](CCC(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[C@@H](CCCN)C(=O)O	3832.6	Standard polar	33892256
Gamma glutamyl ornithine,3TMS,isomer #2	C[Si](C)(C)NCCC[C@H](NC(=O)[C@@H](N)CCC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C	2534.7	Semi standard non polar	33892256
Gamma glutamyl ornithine,3TMS,isomer #2	C[Si](C)(C)NCCC[C@H](NC(=O)[C@@H](N)CCC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C	2457.4	Standard non polar	33892256
Gamma glutamyl ornithine,3TMS,isomer #2	C[Si](C)(C)NCCC[C@H](NC(=O)[C@@H](N)CCC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C	4119.2	Standard polar	33892256
Gamma glutamyl ornithine,3TMS,isomer #3	C[Si](C)(C)OC(=O)CC[C@H](N)C(=O)N([C@@H](CCCN)C(=O)O[Si](C)(C)C)[Si](C)(C)C	2349.1	Semi standard non polar	33892256
Gamma glutamyl ornithine,3TMS,isomer #3	C[Si](C)(C)OC(=O)CC[C@H](N)C(=O)N([C@@H](CCCN)C(=O)O[Si](C)(C)C)[Si](C)(C)C	2383.8	Standard non polar	33892256
Gamma glutamyl ornithine,3TMS,isomer #3	C[Si](C)(C)OC(=O)CC[C@H](N)C(=O)N([C@@H](CCCN)C(=O)O[Si](C)(C)C)[Si](C)(C)C	4282.3	Standard polar	33892256
Gamma glutamyl ornithine,3TMS,isomer #4	C[Si](C)(C)NCCC[C@H](NC(=O)[C@H](CCC(=O)O[Si](C)(C)C)N[Si](C)(C)C)C(=O)O	2582.9	Semi standard non polar	33892256
Gamma glutamyl ornithine,3TMS,isomer #4	C[Si](C)(C)NCCC[C@H](NC(=O)[C@H](CCC(=O)O[Si](C)(C)C)N[Si](C)(C)C)C(=O)O	2594.2	Standard non polar	33892256
Gamma glutamyl ornithine,3TMS,isomer #4	C[Si](C)(C)NCCC[C@H](NC(=O)[C@H](CCC(=O)O[Si](C)(C)C)N[Si](C)(C)C)C(=O)O	3626.4	Standard polar	33892256
Gamma glutamyl ornithine,3TMS,isomer #5	C[Si](C)(C)OC(=O)CC[C@@H](C(=O)N[C@@H](CCCN)C(=O)O)N([Si](C)(C)C)[Si](C)(C)C	2576.0	Semi standard non polar	33892256
Gamma glutamyl ornithine,3TMS,isomer #5	C[Si](C)(C)OC(=O)CC[C@@H](C(=O)N[C@@H](CCCN)C(=O)O)N([Si](C)(C)C)[Si](C)(C)C	2575.9	Standard non polar	33892256
Gamma glutamyl ornithine,3TMS,isomer #5	C[Si](C)(C)OC(=O)CC[C@@H](C(=O)N[C@@H](CCCN)C(=O)O)N([Si](C)(C)C)[Si](C)(C)C	3945.4	Standard polar	33892256
Gamma glutamyl ornithine,3TMS,isomer #6	C[Si](C)(C)N[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)N([C@@H](CCCN)C(=O)O)[Si](C)(C)C	2411.9	Semi standard non polar	33892256
Gamma glutamyl ornithine,3TMS,isomer #6	C[Si](C)(C)N[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)N([C@@H](CCCN)C(=O)O)[Si](C)(C)C	2482.7	Standard non polar	33892256
Gamma glutamyl ornithine,3TMS,isomer #6	C[Si](C)(C)N[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)N([C@@H](CCCN)C(=O)O)[Si](C)(C)C	3781.5	Standard polar	33892256
Gamma glutamyl ornithine,3TMS,isomer #7	C[Si](C)(C)OC(=O)CC[C@H](N)C(=O)N[C@@H](CCCN([Si](C)(C)C)[Si](C)(C)C)C(=O)O	2708.3	Semi standard non polar	33892256
Gamma glutamyl ornithine,3TMS,isomer #7	C[Si](C)(C)OC(=O)CC[C@H](N)C(=O)N[C@@H](CCCN([Si](C)(C)C)[Si](C)(C)C)C(=O)O	2567.2	Standard non polar	33892256
Gamma glutamyl ornithine,3TMS,isomer #7	C[Si](C)(C)OC(=O)CC[C@H](N)C(=O)N[C@@H](CCCN([Si](C)(C)C)[Si](C)(C)C)C(=O)O	4237.7	Standard polar	33892256
Gamma glutamyl ornithine,3TMS,isomer #8	C[Si](C)(C)NCCC[C@@H](C(=O)O)N(C(=O)[C@@H](N)CCC(=O)O[Si](C)(C)C)[Si](C)(C)C	2468.7	Semi standard non polar	33892256
Gamma glutamyl ornithine,3TMS,isomer #8	C[Si](C)(C)NCCC[C@@H](C(=O)O)N(C(=O)[C@@H](N)CCC(=O)O[Si](C)(C)C)[Si](C)(C)C	2522.9	Standard non polar	33892256
Gamma glutamyl ornithine,3TMS,isomer #8	C[Si](C)(C)NCCC[C@@H](C(=O)O)N(C(=O)[C@@H](N)CCC(=O)O[Si](C)(C)C)[Si](C)(C)C	3850.0	Standard polar	33892256
Gamma glutamyl ornithine,3TMS,isomer #9	C[Si](C)(C)NCCC[C@H](NC(=O)[C@H](CCC(=O)O)N[Si](C)(C)C)C(=O)O[Si](C)(C)C	2588.1	Semi standard non polar	33892256
Gamma glutamyl ornithine,3TMS,isomer #9	C[Si](C)(C)NCCC[C@H](NC(=O)[C@H](CCC(=O)O)N[Si](C)(C)C)C(=O)O[Si](C)(C)C	2552.6	Standard non polar	33892256
Gamma glutamyl ornithine,3TMS,isomer #9	C[Si](C)(C)NCCC[C@H](NC(=O)[C@H](CCC(=O)O)N[Si](C)(C)C)C(=O)O[Si](C)(C)C	3552.9	Standard polar	33892256
Gamma glutamyl ornithine,4TMS,isomer #1	C[Si](C)(C)NCCC[C@H](NC(=O)[C@H](CCC(=O)O[Si](C)(C)C)N[Si](C)(C)C)C(=O)O[Si](C)(C)C	2569.2	Semi standard non polar	33892256
Gamma glutamyl ornithine,4TMS,isomer #1	C[Si](C)(C)NCCC[C@H](NC(=O)[C@H](CCC(=O)O[Si](C)(C)C)N[Si](C)(C)C)C(=O)O[Si](C)(C)C	2598.0	Standard non polar	33892256
Gamma glutamyl ornithine,4TMS,isomer #1	C[Si](C)(C)NCCC[C@H](NC(=O)[C@H](CCC(=O)O[Si](C)(C)C)N[Si](C)(C)C)C(=O)O[Si](C)(C)C	3188.8	Standard polar	33892256
Gamma glutamyl ornithine,4TMS,isomer #10	C[Si](C)(C)OC(=O)CC[C@H](N)C(=O)N([C@@H](CCCN([Si](C)(C)C)[Si](C)(C)C)C(=O)O)[Si](C)(C)C	2665.5	Semi standard non polar	33892256
Gamma glutamyl ornithine,4TMS,isomer #10	C[Si](C)(C)OC(=O)CC[C@H](N)C(=O)N([C@@H](CCCN([Si](C)(C)C)[Si](C)(C)C)C(=O)O)[Si](C)(C)C	2609.7	Standard non polar	33892256
Gamma glutamyl ornithine,4TMS,isomer #10	C[Si](C)(C)OC(=O)CC[C@H](N)C(=O)N([C@@H](CCCN([Si](C)(C)C)[Si](C)(C)C)C(=O)O)[Si](C)(C)C	3702.4	Standard polar	33892256
Gamma glutamyl ornithine,4TMS,isomer #11	C[Si](C)(C)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCN([Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	2731.6	Semi standard non polar	33892256
Gamma glutamyl ornithine,4TMS,isomer #11	C[Si](C)(C)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCN([Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	2619.2	Standard non polar	33892256
Gamma glutamyl ornithine,4TMS,isomer #11	C[Si](C)(C)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCN([Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	3317.5	Standard polar	33892256
Gamma glutamyl ornithine,4TMS,isomer #12	C[Si](C)(C)NCCC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)[C@H](CCC(=O)O)N[Si](C)(C)C)[Si](C)(C)C	2518.3	Semi standard non polar	33892256
Gamma glutamyl ornithine,4TMS,isomer #12	C[Si](C)(C)NCCC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)[C@H](CCC(=O)O)N[Si](C)(C)C)[Si](C)(C)C	2604.4	Standard non polar	33892256
Gamma glutamyl ornithine,4TMS,isomer #12	C[Si](C)(C)NCCC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)[C@H](CCC(=O)O)N[Si](C)(C)C)[Si](C)(C)C	3152.9	Standard polar	33892256
Gamma glutamyl ornithine,4TMS,isomer #13	C[Si](C)(C)NCCC[C@H](NC(=O)[C@H](CCC(=O)O)N([Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	2698.7	Semi standard non polar	33892256
Gamma glutamyl ornithine,4TMS,isomer #13	C[Si](C)(C)NCCC[C@H](NC(=O)[C@H](CCC(=O)O)N([Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	2661.2	Standard non polar	33892256
Gamma glutamyl ornithine,4TMS,isomer #13	C[Si](C)(C)NCCC[C@H](NC(=O)[C@H](CCC(=O)O)N([Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	3250.8	Standard polar	33892256
Gamma glutamyl ornithine,4TMS,isomer #14	C[Si](C)(C)OC(=O)[C@H](CCCN([Si](C)(C)C)[Si](C)(C)C)N(C(=O)[C@@H](N)CCC(=O)O)[Si](C)(C)C	2669.7	Semi standard non polar	33892256
Gamma glutamyl ornithine,4TMS,isomer #14	C[Si](C)(C)OC(=O)[C@H](CCCN([Si](C)(C)C)[Si](C)(C)C)N(C(=O)[C@@H](N)CCC(=O)O)[Si](C)(C)C	2578.8	Standard non polar	33892256
Gamma glutamyl ornithine,4TMS,isomer #14	C[Si](C)(C)OC(=O)[C@H](CCCN([Si](C)(C)C)[Si](C)(C)C)N(C(=O)[C@@H](N)CCC(=O)O)[Si](C)(C)C	3677.3	Standard polar	33892256
Gamma glutamyl ornithine,4TMS,isomer #15	C[Si](C)(C)OC(=O)[C@H](CCCN)N(C(=O)[C@H](CCC(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	2593.2	Semi standard non polar	33892256
Gamma glutamyl ornithine,4TMS,isomer #15	C[Si](C)(C)OC(=O)[C@H](CCCN)N(C(=O)[C@H](CCC(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	2572.5	Standard non polar	33892256
Gamma glutamyl ornithine,4TMS,isomer #15	C[Si](C)(C)OC(=O)[C@H](CCCN)N(C(=O)[C@H](CCC(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3571.7	Standard polar	33892256
Gamma glutamyl ornithine,4TMS,isomer #16	C[Si](C)(C)N(CCC[C@H](NC(=O)[C@H](CCC(=O)O)N([Si](C)(C)C)[Si](C)(C)C)C(=O)O)[Si](C)(C)C	2892.2	Semi standard non polar	33892256
Gamma glutamyl ornithine,4TMS,isomer #16	C[Si](C)(C)N(CCC[C@H](NC(=O)[C@H](CCC(=O)O)N([Si](C)(C)C)[Si](C)(C)C)C(=O)O)[Si](C)(C)C	2721.1	Standard non polar	33892256
Gamma glutamyl ornithine,4TMS,isomer #16	C[Si](C)(C)N(CCC[C@H](NC(=O)[C@H](CCC(=O)O)N([Si](C)(C)C)[Si](C)(C)C)C(=O)O)[Si](C)(C)C	3456.2	Standard polar	33892256
Gamma glutamyl ornithine,4TMS,isomer #17	C[Si](C)(C)N[C@@H](CCC(=O)O)C(=O)N([C@@H](CCCN([Si](C)(C)C)[Si](C)(C)C)C(=O)O)[Si](C)(C)C	2710.4	Semi standard non polar	33892256
Gamma glutamyl ornithine,4TMS,isomer #17	C[Si](C)(C)N[C@@H](CCC(=O)O)C(=O)N([C@@H](CCCN([Si](C)(C)C)[Si](C)(C)C)C(=O)O)[Si](C)(C)C	2663.8	Standard non polar	33892256
Gamma glutamyl ornithine,4TMS,isomer #17	C[Si](C)(C)N[C@@H](CCC(=O)O)C(=O)N([C@@H](CCCN([Si](C)(C)C)[Si](C)(C)C)C(=O)O)[Si](C)(C)C	3331.6	Standard polar	33892256
Gamma glutamyl ornithine,4TMS,isomer #18	C[Si](C)(C)NCCC[C@@H](C(=O)O)N(C(=O)[C@H](CCC(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	2658.0	Semi standard non polar	33892256
Gamma glutamyl ornithine,4TMS,isomer #18	C[Si](C)(C)NCCC[C@@H](C(=O)O)N(C(=O)[C@H](CCC(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	2691.9	Standard non polar	33892256
Gamma glutamyl ornithine,4TMS,isomer #18	C[Si](C)(C)NCCC[C@@H](C(=O)O)N(C(=O)[C@H](CCC(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3283.8	Standard polar	33892256
Gamma glutamyl ornithine,4TMS,isomer #2	C[Si](C)(C)OC(=O)CC[C@@H](C(=O)N[C@@H](CCCN)C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2565.4	Semi standard non polar	33892256
Gamma glutamyl ornithine,4TMS,isomer #2	C[Si](C)(C)OC(=O)CC[C@@H](C(=O)N[C@@H](CCCN)C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2581.4	Standard non polar	33892256
Gamma glutamyl ornithine,4TMS,isomer #2	C[Si](C)(C)OC(=O)CC[C@@H](C(=O)N[C@@H](CCCN)C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3661.8	Standard polar	33892256
Gamma glutamyl ornithine,4TMS,isomer #3	C[Si](C)(C)N[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)N([C@@H](CCCN)C(=O)O[Si](C)(C)C)[Si](C)(C)C	2385.6	Semi standard non polar	33892256
Gamma glutamyl ornithine,4TMS,isomer #3	C[Si](C)(C)N[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)N([C@@H](CCCN)C(=O)O[Si](C)(C)C)[Si](C)(C)C	2501.8	Standard non polar	33892256
Gamma glutamyl ornithine,4TMS,isomer #3	C[Si](C)(C)N[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)N([C@@H](CCCN)C(=O)O[Si](C)(C)C)[Si](C)(C)C	3572.1	Standard polar	33892256
Gamma glutamyl ornithine,4TMS,isomer #4	C[Si](C)(C)OC(=O)CC[C@H](N)C(=O)N[C@@H](CCCN([Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	2694.7	Semi standard non polar	33892256
Gamma glutamyl ornithine,4TMS,isomer #4	C[Si](C)(C)OC(=O)CC[C@H](N)C(=O)N[C@@H](CCCN([Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	2562.0	Standard non polar	33892256
Gamma glutamyl ornithine,4TMS,isomer #4	C[Si](C)(C)OC(=O)CC[C@H](N)C(=O)N[C@@H](CCCN([Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	3928.4	Standard polar	33892256
Gamma glutamyl ornithine,4TMS,isomer #5	C[Si](C)(C)NCCC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)[C@@H](N)CCC(=O)O[Si](C)(C)C)[Si](C)(C)C	2443.6	Semi standard non polar	33892256
Gamma glutamyl ornithine,4TMS,isomer #5	C[Si](C)(C)NCCC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)[C@@H](N)CCC(=O)O[Si](C)(C)C)[Si](C)(C)C	2530.0	Standard non polar	33892256
Gamma glutamyl ornithine,4TMS,isomer #5	C[Si](C)(C)NCCC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)[C@@H](N)CCC(=O)O[Si](C)(C)C)[Si](C)(C)C	3631.3	Standard polar	33892256
Gamma glutamyl ornithine,4TMS,isomer #6	C[Si](C)(C)N[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)N[C@@H](CCCN([Si](C)(C)C)[Si](C)(C)C)C(=O)O	2722.7	Semi standard non polar	33892256
Gamma glutamyl ornithine,4TMS,isomer #6	C[Si](C)(C)N[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)N[C@@H](CCCN([Si](C)(C)C)[Si](C)(C)C)C(=O)O	2659.3	Standard non polar	33892256
Gamma glutamyl ornithine,4TMS,isomer #6	C[Si](C)(C)N[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)N[C@@H](CCCN([Si](C)(C)C)[Si](C)(C)C)C(=O)O	3385.3	Standard polar	33892256
Gamma glutamyl ornithine,4TMS,isomer #7	C[Si](C)(C)NCCC[C@@H](C(=O)O)N(C(=O)[C@H](CCC(=O)O[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C	2503.6	Semi standard non polar	33892256
Gamma glutamyl ornithine,4TMS,isomer #7	C[Si](C)(C)NCCC[C@@H](C(=O)O)N(C(=O)[C@H](CCC(=O)O[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C	2629.2	Standard non polar	33892256
Gamma glutamyl ornithine,4TMS,isomer #7	C[Si](C)(C)NCCC[C@@H](C(=O)O)N(C(=O)[C@H](CCC(=O)O[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C	3177.0	Standard polar	33892256
Gamma glutamyl ornithine,4TMS,isomer #8	C[Si](C)(C)NCCC[C@H](NC(=O)[C@H](CCC(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)C(=O)O	2687.8	Semi standard non polar	33892256
Gamma glutamyl ornithine,4TMS,isomer #8	C[Si](C)(C)NCCC[C@H](NC(=O)[C@H](CCC(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)C(=O)O	2692.0	Standard non polar	33892256
Gamma glutamyl ornithine,4TMS,isomer #8	C[Si](C)(C)NCCC[C@H](NC(=O)[C@H](CCC(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)C(=O)O	3327.3	Standard polar	33892256
Gamma glutamyl ornithine,4TMS,isomer #9	C[Si](C)(C)OC(=O)CC[C@@H](C(=O)N([C@@H](CCCN)C(=O)O)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2570.9	Semi standard non polar	33892256
Gamma glutamyl ornithine,4TMS,isomer #9	C[Si](C)(C)OC(=O)CC[C@@H](C(=O)N([C@@H](CCCN)C(=O)O)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2602.8	Standard non polar	33892256
Gamma glutamyl ornithine,4TMS,isomer #9	C[Si](C)(C)OC(=O)CC[C@@H](C(=O)N([C@@H](CCCN)C(=O)O)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3583.6	Standard polar	33892256
Gamma glutamyl ornithine,5TMS,isomer #1	C[Si](C)(C)N[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)N[C@@H](CCCN([Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	2704.2	Semi standard non polar	33892256
Gamma glutamyl ornithine,5TMS,isomer #1	C[Si](C)(C)N[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)N[C@@H](CCCN([Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	2659.3	Standard non polar	33892256
Gamma glutamyl ornithine,5TMS,isomer #1	C[Si](C)(C)N[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)N[C@@H](CCCN([Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	3038.3	Standard polar	33892256
Gamma glutamyl ornithine,5TMS,isomer #10	C[Si](C)(C)N[C@@H](CCC(=O)O)C(=O)N([C@@H](CCCN([Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C)[Si](C)(C)C	2714.5	Semi standard non polar	33892256
Gamma glutamyl ornithine,5TMS,isomer #10	C[Si](C)(C)N[C@@H](CCC(=O)O)C(=O)N([C@@H](CCCN([Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C)[Si](C)(C)C	2677.2	Standard non polar	33892256
Gamma glutamyl ornithine,5TMS,isomer #10	C[Si](C)(C)N[C@@H](CCC(=O)O)C(=O)N([C@@H](CCCN([Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C)[Si](C)(C)C	3023.3	Standard polar	33892256
Gamma glutamyl ornithine,5TMS,isomer #11	C[Si](C)(C)NCCC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)[C@H](CCC(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	2673.6	Semi standard non polar	33892256
Gamma glutamyl ornithine,5TMS,isomer #11	C[Si](C)(C)NCCC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)[C@H](CCC(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	2701.0	Standard non polar	33892256
Gamma glutamyl ornithine,5TMS,isomer #11	C[Si](C)(C)NCCC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)[C@H](CCC(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	2958.5	Standard polar	33892256
Gamma glutamyl ornithine,5TMS,isomer #12	C[Si](C)(C)N(C(=O)[C@H](CCC(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[C@@H](CCCN([Si](C)(C)C)[Si](C)(C)C)C(=O)O	2883.5	Semi standard non polar	33892256
Gamma glutamyl ornithine,5TMS,isomer #12	C[Si](C)(C)N(C(=O)[C@H](CCC(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[C@@H](CCCN([Si](C)(C)C)[Si](C)(C)C)C(=O)O	2767.9	Standard non polar	33892256
Gamma glutamyl ornithine,5TMS,isomer #12	C[Si](C)(C)N(C(=O)[C@H](CCC(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[C@@H](CCCN([Si](C)(C)C)[Si](C)(C)C)C(=O)O	3166.1	Standard polar	33892256
Gamma glutamyl ornithine,5TMS,isomer #2	C[Si](C)(C)NCCC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)[C@H](CCC(=O)O[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C	2475.9	Semi standard non polar	33892256
Gamma glutamyl ornithine,5TMS,isomer #2	C[Si](C)(C)NCCC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)[C@H](CCC(=O)O[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C	2638.2	Standard non polar	33892256
Gamma glutamyl ornithine,5TMS,isomer #2	C[Si](C)(C)NCCC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)[C@H](CCC(=O)O[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C	2848.9	Standard polar	33892256
Gamma glutamyl ornithine,5TMS,isomer #3	C[Si](C)(C)NCCC[C@H](NC(=O)[C@H](CCC(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	2635.7	Semi standard non polar	33892256
Gamma glutamyl ornithine,5TMS,isomer #3	C[Si](C)(C)NCCC[C@H](NC(=O)[C@H](CCC(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	2699.9	Standard non polar	33892256
Gamma glutamyl ornithine,5TMS,isomer #3	C[Si](C)(C)NCCC[C@H](NC(=O)[C@H](CCC(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	2961.5	Standard polar	33892256
Gamma glutamyl ornithine,5TMS,isomer #4	C[Si](C)(C)OC(=O)CC[C@@H](C(=O)N([C@@H](CCCN)C(=O)O[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2589.3	Semi standard non polar	33892256
Gamma glutamyl ornithine,5TMS,isomer #4	C[Si](C)(C)OC(=O)CC[C@@H](C(=O)N([C@@H](CCCN)C(=O)O[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2623.9	Standard non polar	33892256
Gamma glutamyl ornithine,5TMS,isomer #4	C[Si](C)(C)OC(=O)CC[C@@H](C(=O)N([C@@H](CCCN)C(=O)O[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3404.5	Standard polar	33892256
Gamma glutamyl ornithine,5TMS,isomer #5	C[Si](C)(C)OC(=O)CC[C@H](N)C(=O)N([C@@H](CCCN([Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C)[Si](C)(C)C	2665.3	Semi standard non polar	33892256
Gamma glutamyl ornithine,5TMS,isomer #5	C[Si](C)(C)OC(=O)CC[C@H](N)C(=O)N([C@@H](CCCN([Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C)[Si](C)(C)C	2630.5	Standard non polar	33892256
Gamma glutamyl ornithine,5TMS,isomer #5	C[Si](C)(C)OC(=O)CC[C@H](N)C(=O)N([C@@H](CCCN([Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C)[Si](C)(C)C	3521.4	Standard polar	33892256
Gamma glutamyl ornithine,5TMS,isomer #6	C[Si](C)(C)OC(=O)CC[C@@H](C(=O)N[C@@H](CCCN([Si](C)(C)C)[Si](C)(C)C)C(=O)O)N([Si](C)(C)C)[Si](C)(C)C	2888.8	Semi standard non polar	33892256
Gamma glutamyl ornithine,5TMS,isomer #6	C[Si](C)(C)OC(=O)CC[C@@H](C(=O)N[C@@H](CCCN([Si](C)(C)C)[Si](C)(C)C)C(=O)O)N([Si](C)(C)C)[Si](C)(C)C	2760.1	Standard non polar	33892256
Gamma glutamyl ornithine,5TMS,isomer #6	C[Si](C)(C)OC(=O)CC[C@@H](C(=O)N[C@@H](CCCN([Si](C)(C)C)[Si](C)(C)C)C(=O)O)N([Si](C)(C)C)[Si](C)(C)C	3175.8	Standard polar	33892256
Gamma glutamyl ornithine,5TMS,isomer #7	C[Si](C)(C)N[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)N([C@@H](CCCN([Si](C)(C)C)[Si](C)(C)C)C(=O)O)[Si](C)(C)C	2706.9	Semi standard non polar	33892256
Gamma glutamyl ornithine,5TMS,isomer #7	C[Si](C)(C)N[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)N([C@@H](CCCN([Si](C)(C)C)[Si](C)(C)C)C(=O)O)[Si](C)(C)C	2697.7	Standard non polar	33892256
Gamma glutamyl ornithine,5TMS,isomer #7	C[Si](C)(C)N[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)N([C@@H](CCCN([Si](C)(C)C)[Si](C)(C)C)C(=O)O)[Si](C)(C)C	3054.7	Standard polar	33892256
Gamma glutamyl ornithine,5TMS,isomer #8	C[Si](C)(C)NCCC[C@@H](C(=O)O)N(C(=O)[C@H](CCC(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	2652.7	Semi standard non polar	33892256
Gamma glutamyl ornithine,5TMS,isomer #8	C[Si](C)(C)NCCC[C@@H](C(=O)O)N(C(=O)[C@H](CCC(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	2725.0	Standard non polar	33892256
Gamma glutamyl ornithine,5TMS,isomer #8	C[Si](C)(C)NCCC[C@@H](C(=O)O)N(C(=O)[C@H](CCC(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	2995.0	Standard polar	33892256
Gamma glutamyl ornithine,5TMS,isomer #9	C[Si](C)(C)OC(=O)[C@H](CCCN([Si](C)(C)C)[Si](C)(C)C)NC(=O)[C@H](CCC(=O)O)N([Si](C)(C)C)[Si](C)(C)C	2894.4	Semi standard non polar	33892256
Gamma glutamyl ornithine,5TMS,isomer #9	C[Si](C)(C)OC(=O)[C@H](CCCN([Si](C)(C)C)[Si](C)(C)C)NC(=O)[C@H](CCC(=O)O)N([Si](C)(C)C)[Si](C)(C)C	2730.4	Standard non polar	33892256
Gamma glutamyl ornithine,5TMS,isomer #9	C[Si](C)(C)OC(=O)[C@H](CCCN([Si](C)(C)C)[Si](C)(C)C)NC(=O)[C@H](CCC(=O)O)N([Si](C)(C)C)[Si](C)(C)C	3098.3	Standard polar	33892256
Gamma glutamyl ornithine,6TMS,isomer #1	C[Si](C)(C)OC(=O)CC[C@@H](C(=O)N[C@@H](CCCN([Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2873.7	Semi standard non polar	33892256
Gamma glutamyl ornithine,6TMS,isomer #1	C[Si](C)(C)OC(=O)CC[C@@H](C(=O)N[C@@H](CCCN([Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2765.7	Standard non polar	33892256
Gamma glutamyl ornithine,6TMS,isomer #1	C[Si](C)(C)OC(=O)CC[C@@H](C(=O)N[C@@H](CCCN([Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2868.7	Standard polar	33892256
Gamma glutamyl ornithine,6TMS,isomer #2	C[Si](C)(C)N[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)N([C@@H](CCCN([Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C)[Si](C)(C)C	2694.8	Semi standard non polar	33892256
Gamma glutamyl ornithine,6TMS,isomer #2	C[Si](C)(C)N[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)N([C@@H](CCCN([Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C)[Si](C)(C)C	2713.9	Standard non polar	33892256
Gamma glutamyl ornithine,6TMS,isomer #2	C[Si](C)(C)N[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)N([C@@H](CCCN([Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C)[Si](C)(C)C	2791.8	Standard polar	33892256
Gamma glutamyl ornithine,6TMS,isomer #3	C[Si](C)(C)NCCC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)[C@H](CCC(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	2685.9	Semi standard non polar	33892256
Gamma glutamyl ornithine,6TMS,isomer #3	C[Si](C)(C)NCCC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)[C@H](CCC(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	2736.1	Standard non polar	33892256
Gamma glutamyl ornithine,6TMS,isomer #3	C[Si](C)(C)NCCC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)[C@H](CCC(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	2735.4	Standard polar	33892256
Gamma glutamyl ornithine,6TMS,isomer #4	C[Si](C)(C)OC(=O)CC[C@@H](C(=O)N([C@@H](CCCN([Si](C)(C)C)[Si](C)(C)C)C(=O)O)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2914.1	Semi standard non polar	33892256
Gamma glutamyl ornithine,6TMS,isomer #4	C[Si](C)(C)OC(=O)CC[C@@H](C(=O)N([C@@H](CCCN([Si](C)(C)C)[Si](C)(C)C)C(=O)O)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2805.4	Standard non polar	33892256
Gamma glutamyl ornithine,6TMS,isomer #4	C[Si](C)(C)OC(=O)CC[C@@H](C(=O)N([C@@H](CCCN([Si](C)(C)C)[Si](C)(C)C)C(=O)O)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2905.0	Standard polar	33892256
Gamma glutamyl ornithine,6TMS,isomer #5	C[Si](C)(C)OC(=O)[C@H](CCCN([Si](C)(C)C)[Si](C)(C)C)N(C(=O)[C@H](CCC(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	2925.8	Semi standard non polar	33892256
Gamma glutamyl ornithine,6TMS,isomer #5	C[Si](C)(C)OC(=O)[C@H](CCCN([Si](C)(C)C)[Si](C)(C)C)N(C(=O)[C@H](CCC(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	2784.8	Standard non polar	33892256
Gamma glutamyl ornithine,6TMS,isomer #5	C[Si](C)(C)OC(=O)[C@H](CCCN([Si](C)(C)C)[Si](C)(C)C)N(C(=O)[C@H](CCC(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	2875.4	Standard polar	33892256
Gamma glutamyl ornithine,7TMS,isomer #1	C[Si](C)(C)OC(=O)CC[C@@H](C(=O)N([C@@H](CCCN([Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2951.7	Semi standard non polar	33892256
Gamma glutamyl ornithine,7TMS,isomer #1	C[Si](C)(C)OC(=O)CC[C@@H](C(=O)N([C@@H](CCCN([Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2820.9	Standard non polar	33892256
Gamma glutamyl ornithine,7TMS,isomer #1	C[Si](C)(C)OC(=O)CC[C@@H](C(=O)N([C@@H](CCCN([Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2736.3	Standard polar	33892256
Gamma glutamyl ornithine,1TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC(=O)CC[C@H](N)C(=O)N[C@@H](CCCN)C(=O)O	2671.9	Semi standard non polar	33892256
Gamma glutamyl ornithine,1TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCCN)NC(=O)[C@@H](N)CCC(=O)O	2650.2	Semi standard non polar	33892256
Gamma glutamyl ornithine,1TBDMS,isomer #3	CC(C)(C)[Si](C)(C)NCCC[C@H](NC(=O)[C@@H](N)CCC(=O)O)C(=O)O	2798.6	Semi standard non polar	33892256
Gamma glutamyl ornithine,1TBDMS,isomer #4	CC(C)(C)[Si](C)(C)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCN)C(=O)O	2717.2	Semi standard non polar	33892256
Gamma glutamyl ornithine,1TBDMS,isomer #5	CC(C)(C)[Si](C)(C)N(C(=O)[C@@H](N)CCC(=O)O)[C@@H](CCCN)C(=O)O	2631.7	Semi standard non polar	33892256
Gamma glutamyl ornithine,2TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC(=O)CC[C@H](N)C(=O)N[C@@H](CCCN)C(=O)O[Si](C)(C)C(C)(C)C	2926.6	Semi standard non polar	33892256
Gamma glutamyl ornithine,2TBDMS,isomer #10	CC(C)(C)[Si](C)(C)NCCC[C@@H](C(=O)O)N(C(=O)[C@@H](N)CCC(=O)O)[Si](C)(C)C(C)(C)C	2997.8	Semi standard non polar	33892256
Gamma glutamyl ornithine,2TBDMS,isomer #11	CC(C)(C)[Si](C)(C)N([C@@H](CCC(=O)O)C(=O)N[C@@H](CCCN)C(=O)O)[Si](C)(C)C(C)(C)C	3039.2	Semi standard non polar	33892256
Gamma glutamyl ornithine,2TBDMS,isomer #12	CC(C)(C)[Si](C)(C)N[C@@H](CCC(=O)O)C(=O)N([C@@H](CCCN)C(=O)O)[Si](C)(C)C(C)(C)C	2907.7	Semi standard non polar	33892256
Gamma glutamyl ornithine,2TBDMS,isomer #2	CC(C)(C)[Si](C)(C)N[C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)N[C@@H](CCCN)C(=O)O	2939.6	Semi standard non polar	33892256
Gamma glutamyl ornithine,2TBDMS,isomer #3	CC(C)(C)[Si](C)(C)NCCC[C@H](NC(=O)[C@@H](N)CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)O	3041.9	Semi standard non polar	33892256
Gamma glutamyl ornithine,2TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC(=O)CC[C@H](N)C(=O)N([C@@H](CCCN)C(=O)O)[Si](C)(C)C(C)(C)C	2870.7	Semi standard non polar	33892256
Gamma glutamyl ornithine,2TBDMS,isomer #5	CC(C)(C)[Si](C)(C)NCCC[C@H](NC(=O)[C@@H](N)CCC(=O)O)C(=O)O[Si](C)(C)C(C)(C)C	3002.2	Semi standard non polar	33892256
Gamma glutamyl ornithine,2TBDMS,isomer #6	CC(C)(C)[Si](C)(C)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCN)C(=O)O[Si](C)(C)C(C)(C)C	2913.4	Semi standard non polar	33892256
Gamma glutamyl ornithine,2TBDMS,isomer #7	CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCCN)N(C(=O)[C@@H](N)CCC(=O)O)[Si](C)(C)C(C)(C)C	2864.6	Semi standard non polar	33892256
Gamma glutamyl ornithine,2TBDMS,isomer #8	CC(C)(C)[Si](C)(C)NCCC[C@H](NC(=O)[C@H](CCC(=O)O)N[Si](C)(C)C(C)(C)C)C(=O)O	3085.0	Semi standard non polar	33892256
Gamma glutamyl ornithine,2TBDMS,isomer #9	CC(C)(C)[Si](C)(C)N(CCC[C@H](NC(=O)[C@@H](N)CCC(=O)O)C(=O)O)[Si](C)(C)C(C)(C)C	3146.9	Semi standard non polar	33892256
Gamma glutamyl ornithine,3TBDMS,isomer #1	CC(C)(C)[Si](C)(C)N[C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)N[C@@H](CCCN)C(=O)O[Si](C)(C)C(C)(C)C	3175.8	Semi standard non polar	33892256
Gamma glutamyl ornithine,3TBDMS,isomer #1	CC(C)(C)[Si](C)(C)N[C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)N[C@@H](CCCN)C(=O)O[Si](C)(C)C(C)(C)C	2992.0	Standard non polar	33892256
Gamma glutamyl ornithine,3TBDMS,isomer #1	CC(C)(C)[Si](C)(C)N[C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)N[C@@H](CCCN)C(=O)O[Si](C)(C)C(C)(C)C	3786.7	Standard polar	33892256
Gamma glutamyl ornithine,3TBDMS,isomer #10	CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)NC(=O)[C@@H](N)CCC(=O)O	3351.3	Semi standard non polar	33892256
Gamma glutamyl ornithine,3TBDMS,isomer #10	CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)NC(=O)[C@@H](N)CCC(=O)O	3026.9	Standard non polar	33892256
Gamma glutamyl ornithine,3TBDMS,isomer #10	CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)NC(=O)[C@@H](N)CCC(=O)O	3995.4	Standard polar	33892256
Gamma glutamyl ornithine,3TBDMS,isomer #11	CC(C)(C)[Si](C)(C)NCCC[C@@H](C(=O)O[Si](C)(C)C(C)(C)C)N(C(=O)[C@@H](N)CCC(=O)O)[Si](C)(C)C(C)(C)C	3203.6	Semi standard non polar	33892256
Gamma glutamyl ornithine,3TBDMS,isomer #11	CC(C)(C)[Si](C)(C)NCCC[C@@H](C(=O)O[Si](C)(C)C(C)(C)C)N(C(=O)[C@@H](N)CCC(=O)O)[Si](C)(C)C(C)(C)C	3000.5	Standard non polar	33892256
Gamma glutamyl ornithine,3TBDMS,isomer #11	CC(C)(C)[Si](C)(C)NCCC[C@@H](C(=O)O[Si](C)(C)C(C)(C)C)N(C(=O)[C@@H](N)CCC(=O)O)[Si](C)(C)C(C)(C)C	3796.5	Standard polar	33892256
Gamma glutamyl ornithine,3TBDMS,isomer #12	CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCCN)NC(=O)[C@H](CCC(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3280.7	Semi standard non polar	33892256
Gamma glutamyl ornithine,3TBDMS,isomer #12	CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCCN)NC(=O)[C@H](CCC(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3006.5	Standard non polar	33892256
Gamma glutamyl ornithine,3TBDMS,isomer #12	CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCCN)NC(=O)[C@H](CCC(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3768.2	Standard polar	33892256
Gamma glutamyl ornithine,3TBDMS,isomer #13	CC(C)(C)[Si](C)(C)N[C@@H](CCC(=O)O)C(=O)N([C@@H](CCCN)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3130.5	Semi standard non polar	33892256
Gamma glutamyl ornithine,3TBDMS,isomer #13	CC(C)(C)[Si](C)(C)N[C@@H](CCC(=O)O)C(=O)N([C@@H](CCCN)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	2970.5	Standard non polar	33892256
Gamma glutamyl ornithine,3TBDMS,isomer #13	CC(C)(C)[Si](C)(C)N[C@@H](CCC(=O)O)C(=O)N([C@@H](CCCN)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3726.5	Standard polar	33892256
Gamma glutamyl ornithine,3TBDMS,isomer #14	CC(C)(C)[Si](C)(C)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O	3427.9	Semi standard non polar	33892256
Gamma glutamyl ornithine,3TBDMS,isomer #14	CC(C)(C)[Si](C)(C)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O	3099.8	Standard non polar	33892256
Gamma glutamyl ornithine,3TBDMS,isomer #14	CC(C)(C)[Si](C)(C)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O	3676.6	Standard polar	33892256
Gamma glutamyl ornithine,3TBDMS,isomer #15	CC(C)(C)[Si](C)(C)NCCC[C@@H](C(=O)O)N(C(=O)[C@H](CCC(=O)O)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3269.2	Semi standard non polar	33892256
Gamma glutamyl ornithine,3TBDMS,isomer #15	CC(C)(C)[Si](C)(C)NCCC[C@@H](C(=O)O)N(C(=O)[C@H](CCC(=O)O)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3027.5	Standard non polar	33892256
Gamma glutamyl ornithine,3TBDMS,isomer #15	CC(C)(C)[Si](C)(C)NCCC[C@@H](C(=O)O)N(C(=O)[C@H](CCC(=O)O)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3548.9	Standard polar	33892256
Gamma glutamyl ornithine,3TBDMS,isomer #16	CC(C)(C)[Si](C)(C)NCCC[C@H](NC(=O)[C@H](CCC(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O	3430.0	Semi standard non polar	33892256
Gamma glutamyl ornithine,3TBDMS,isomer #16	CC(C)(C)[Si](C)(C)NCCC[C@H](NC(=O)[C@H](CCC(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O	3097.2	Standard non polar	33892256
Gamma glutamyl ornithine,3TBDMS,isomer #16	CC(C)(C)[Si](C)(C)NCCC[C@H](NC(=O)[C@H](CCC(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O	3624.2	Standard polar	33892256
Gamma glutamyl ornithine,3TBDMS,isomer #17	CC(C)(C)[Si](C)(C)N(C(=O)[C@@H](N)CCC(=O)O)[C@@H](CCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O	3328.5	Semi standard non polar	33892256
Gamma glutamyl ornithine,3TBDMS,isomer #17	CC(C)(C)[Si](C)(C)N(C(=O)[C@@H](N)CCC(=O)O)[C@@H](CCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O	3043.3	Standard non polar	33892256
Gamma glutamyl ornithine,3TBDMS,isomer #17	CC(C)(C)[Si](C)(C)N(C(=O)[C@@H](N)CCC(=O)O)[C@@H](CCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O	3854.2	Standard polar	33892256
Gamma glutamyl ornithine,3TBDMS,isomer #18	CC(C)(C)[Si](C)(C)N(C(=O)[C@H](CCC(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[C@@H](CCCN)C(=O)O	3246.4	Semi standard non polar	33892256
Gamma glutamyl ornithine,3TBDMS,isomer #18	CC(C)(C)[Si](C)(C)N(C(=O)[C@H](CCC(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[C@@H](CCCN)C(=O)O	3014.1	Standard non polar	33892256
Gamma glutamyl ornithine,3TBDMS,isomer #18	CC(C)(C)[Si](C)(C)N(C(=O)[C@H](CCC(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[C@@H](CCCN)C(=O)O	3740.9	Standard polar	33892256
Gamma glutamyl ornithine,3TBDMS,isomer #2	CC(C)(C)[Si](C)(C)NCCC[C@H](NC(=O)[C@@H](N)CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C	3223.4	Semi standard non polar	33892256
Gamma glutamyl ornithine,3TBDMS,isomer #2	CC(C)(C)[Si](C)(C)NCCC[C@H](NC(=O)[C@@H](N)CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C	3006.9	Standard non polar	33892256
Gamma glutamyl ornithine,3TBDMS,isomer #2	CC(C)(C)[Si](C)(C)NCCC[C@H](NC(=O)[C@@H](N)CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C	3972.6	Standard polar	33892256
Gamma glutamyl ornithine,3TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC(=O)CC[C@H](N)C(=O)N([C@@H](CCCN)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3102.3	Semi standard non polar	33892256
Gamma glutamyl ornithine,3TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC(=O)CC[C@H](N)C(=O)N([C@@H](CCCN)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	2948.9	Standard non polar	33892256
Gamma glutamyl ornithine,3TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC(=O)CC[C@H](N)C(=O)N([C@@H](CCCN)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4172.4	Standard polar	33892256
Gamma glutamyl ornithine,3TBDMS,isomer #4	CC(C)(C)[Si](C)(C)NCCC[C@H](NC(=O)[C@H](CCC(=O)O[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C)C(=O)O	3287.2	Semi standard non polar	33892256
Gamma glutamyl ornithine,3TBDMS,isomer #4	CC(C)(C)[Si](C)(C)NCCC[C@H](NC(=O)[C@H](CCC(=O)O[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C)C(=O)O	3069.6	Standard non polar	33892256
Gamma glutamyl ornithine,3TBDMS,isomer #4	CC(C)(C)[Si](C)(C)NCCC[C@H](NC(=O)[C@H](CCC(=O)O[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C)C(=O)O	3580.4	Standard polar	33892256
Gamma glutamyl ornithine,3TBDMS,isomer #5	CC(C)(C)[Si](C)(C)OC(=O)CC[C@@H](C(=O)N[C@@H](CCCN)C(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3303.0	Semi standard non polar	33892256
Gamma glutamyl ornithine,3TBDMS,isomer #5	CC(C)(C)[Si](C)(C)OC(=O)CC[C@@H](C(=O)N[C@@H](CCCN)C(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3051.9	Standard non polar	33892256
Gamma glutamyl ornithine,3TBDMS,isomer #5	CC(C)(C)[Si](C)(C)OC(=O)CC[C@@H](C(=O)N[C@@H](CCCN)C(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3796.8	Standard polar	33892256
Gamma glutamyl ornithine,3TBDMS,isomer #6	CC(C)(C)[Si](C)(C)N[C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)N([C@@H](CCCN)C(=O)O)[Si](C)(C)C(C)(C)C	3137.9	Semi standard non polar	33892256
Gamma glutamyl ornithine,3TBDMS,isomer #6	CC(C)(C)[Si](C)(C)N[C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)N([C@@H](CCCN)C(=O)O)[Si](C)(C)C(C)(C)C	2995.6	Standard non polar	33892256
Gamma glutamyl ornithine,3TBDMS,isomer #6	CC(C)(C)[Si](C)(C)N[C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)N([C@@H](CCCN)C(=O)O)[Si](C)(C)C(C)(C)C	3726.8	Standard polar	33892256
Gamma glutamyl ornithine,3TBDMS,isomer #7	CC(C)(C)[Si](C)(C)OC(=O)CC[C@H](N)C(=O)N[C@@H](CCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O	3394.7	Semi standard non polar	33892256
Gamma glutamyl ornithine,3TBDMS,isomer #7	CC(C)(C)[Si](C)(C)OC(=O)CC[C@H](N)C(=O)N[C@@H](CCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O	3068.3	Standard non polar	33892256
Gamma glutamyl ornithine,3TBDMS,isomer #7	CC(C)(C)[Si](C)(C)OC(=O)CC[C@H](N)C(=O)N[C@@H](CCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O	4038.3	Standard polar	33892256
Gamma glutamyl ornithine,3TBDMS,isomer #8	CC(C)(C)[Si](C)(C)NCCC[C@@H](C(=O)O)N(C(=O)[C@@H](N)CCC(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3227.5	Semi standard non polar	33892256
Gamma glutamyl ornithine,3TBDMS,isomer #8	CC(C)(C)[Si](C)(C)NCCC[C@@H](C(=O)O)N(C(=O)[C@@H](N)CCC(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3024.4	Standard non polar	33892256
Gamma glutamyl ornithine,3TBDMS,isomer #8	CC(C)(C)[Si](C)(C)NCCC[C@@H](C(=O)O)N(C(=O)[C@@H](N)CCC(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3808.6	Standard polar	33892256
Gamma glutamyl ornithine,3TBDMS,isomer #9	CC(C)(C)[Si](C)(C)NCCC[C@H](NC(=O)[C@H](CCC(=O)O)N[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C	3259.7	Semi standard non polar	33892256
Gamma glutamyl ornithine,3TBDMS,isomer #9	CC(C)(C)[Si](C)(C)NCCC[C@H](NC(=O)[C@H](CCC(=O)O)N[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C	3032.7	Standard non polar	33892256
Gamma glutamyl ornithine,3TBDMS,isomer #9	CC(C)(C)[Si](C)(C)NCCC[C@H](NC(=O)[C@H](CCC(=O)O)N[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C	3542.7	Standard polar	33892256
Gamma glutamyl ornithine,4TBDMS,isomer #1	CC(C)(C)[Si](C)(C)NCCC[C@H](NC(=O)[C@H](CCC(=O)O[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C	3442.0	Semi standard non polar	33892256
Gamma glutamyl ornithine,4TBDMS,isomer #1	CC(C)(C)[Si](C)(C)NCCC[C@H](NC(=O)[C@H](CCC(=O)O[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C	3213.3	Standard non polar	33892256
Gamma glutamyl ornithine,4TBDMS,isomer #1	CC(C)(C)[Si](C)(C)NCCC[C@H](NC(=O)[C@H](CCC(=O)O[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C	3409.5	Standard polar	33892256
Gamma glutamyl ornithine,4TBDMS,isomer #10	CC(C)(C)[Si](C)(C)OC(=O)CC[C@H](N)C(=O)N([C@@H](CCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O)[Si](C)(C)C(C)(C)C	3564.3	Semi standard non polar	33892256
Gamma glutamyl ornithine,4TBDMS,isomer #10	CC(C)(C)[Si](C)(C)OC(=O)CC[C@H](N)C(=O)N([C@@H](CCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O)[Si](C)(C)C(C)(C)C	3240.8	Standard non polar	33892256
Gamma glutamyl ornithine,4TBDMS,isomer #10	CC(C)(C)[Si](C)(C)OC(=O)CC[C@H](N)C(=O)N([C@@H](CCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O)[Si](C)(C)C(C)(C)C	3751.4	Standard polar	33892256
Gamma glutamyl ornithine,4TBDMS,isomer #11	CC(C)(C)[Si](C)(C)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C	3603.3	Semi standard non polar	33892256
Gamma glutamyl ornithine,4TBDMS,isomer #11	CC(C)(C)[Si](C)(C)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C	3239.6	Standard non polar	33892256
Gamma glutamyl ornithine,4TBDMS,isomer #11	CC(C)(C)[Si](C)(C)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C	3492.6	Standard polar	33892256
Gamma glutamyl ornithine,4TBDMS,isomer #12	CC(C)(C)[Si](C)(C)NCCC[C@@H](C(=O)O[Si](C)(C)C(C)(C)C)N(C(=O)[C@H](CCC(=O)O)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3443.6	Semi standard non polar	33892256
Gamma glutamyl ornithine,4TBDMS,isomer #12	CC(C)(C)[Si](C)(C)NCCC[C@@H](C(=O)O[Si](C)(C)C(C)(C)C)N(C(=O)[C@H](CCC(=O)O)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3193.6	Standard non polar	33892256
Gamma glutamyl ornithine,4TBDMS,isomer #12	CC(C)(C)[Si](C)(C)NCCC[C@@H](C(=O)O[Si](C)(C)C(C)(C)C)N(C(=O)[C@H](CCC(=O)O)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3408.2	Standard polar	33892256
Gamma glutamyl ornithine,4TBDMS,isomer #13	CC(C)(C)[Si](C)(C)NCCC[C@H](NC(=O)[C@H](CCC(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C	3620.9	Semi standard non polar	33892256
Gamma glutamyl ornithine,4TBDMS,isomer #13	CC(C)(C)[Si](C)(C)NCCC[C@H](NC(=O)[C@H](CCC(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C	3250.8	Standard non polar	33892256
Gamma glutamyl ornithine,4TBDMS,isomer #13	CC(C)(C)[Si](C)(C)NCCC[C@H](NC(=O)[C@H](CCC(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C	3439.6	Standard polar	33892256
Gamma glutamyl ornithine,4TBDMS,isomer #14	CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)N(C(=O)[C@@H](N)CCC(=O)O)[Si](C)(C)C(C)(C)C	3539.8	Semi standard non polar	33892256
Gamma glutamyl ornithine,4TBDMS,isomer #14	CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)N(C(=O)[C@@H](N)CCC(=O)O)[Si](C)(C)C(C)(C)C	3226.1	Standard non polar	33892256
Gamma glutamyl ornithine,4TBDMS,isomer #14	CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)N(C(=O)[C@@H](N)CCC(=O)O)[Si](C)(C)C(C)(C)C	3736.9	Standard polar	33892256
Gamma glutamyl ornithine,4TBDMS,isomer #15	CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCCN)N(C(=O)[C@H](CCC(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3479.2	Semi standard non polar	33892256
Gamma glutamyl ornithine,4TBDMS,isomer #15	CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCCN)N(C(=O)[C@H](CCC(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3205.6	Standard non polar	33892256
Gamma glutamyl ornithine,4TBDMS,isomer #15	CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCCN)N(C(=O)[C@H](CCC(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3637.4	Standard polar	33892256
Gamma glutamyl ornithine,4TBDMS,isomer #16	CC(C)(C)[Si](C)(C)N(CCC[C@H](NC(=O)[C@H](CCC(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O)[Si](C)(C)C(C)(C)C	3748.5	Semi standard non polar	33892256
Gamma glutamyl ornithine,4TBDMS,isomer #16	CC(C)(C)[Si](C)(C)N(CCC[C@H](NC(=O)[C@H](CCC(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O)[Si](C)(C)C(C)(C)C	3311.6	Standard non polar	33892256
Gamma glutamyl ornithine,4TBDMS,isomer #16	CC(C)(C)[Si](C)(C)N(CCC[C@H](NC(=O)[C@H](CCC(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O)[Si](C)(C)C(C)(C)C	3567.8	Standard polar	33892256
Gamma glutamyl ornithine,4TBDMS,isomer #17	CC(C)(C)[Si](C)(C)N[C@@H](CCC(=O)O)C(=O)N([C@@H](CCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O)[Si](C)(C)C(C)(C)C	3594.0	Semi standard non polar	33892256
Gamma glutamyl ornithine,4TBDMS,isomer #17	CC(C)(C)[Si](C)(C)N[C@@H](CCC(=O)O)C(=O)N([C@@H](CCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O)[Si](C)(C)C(C)(C)C	3251.6	Standard non polar	33892256
Gamma glutamyl ornithine,4TBDMS,isomer #17	CC(C)(C)[Si](C)(C)N[C@@H](CCC(=O)O)C(=O)N([C@@H](CCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O)[Si](C)(C)C(C)(C)C	3518.0	Standard polar	33892256
Gamma glutamyl ornithine,4TBDMS,isomer #18	CC(C)(C)[Si](C)(C)NCCC[C@@H](C(=O)O)N(C(=O)[C@H](CCC(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3598.0	Semi standard non polar	33892256
Gamma glutamyl ornithine,4TBDMS,isomer #18	CC(C)(C)[Si](C)(C)NCCC[C@@H](C(=O)O)N(C(=O)[C@H](CCC(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3263.1	Standard non polar	33892256
Gamma glutamyl ornithine,4TBDMS,isomer #18	CC(C)(C)[Si](C)(C)NCCC[C@@H](C(=O)O)N(C(=O)[C@H](CCC(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3478.6	Standard polar	33892256
Gamma glutamyl ornithine,4TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC(=O)CC[C@@H](C(=O)N[C@@H](CCCN)C(=O)O[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3534.8	Semi standard non polar	33892256
Gamma glutamyl ornithine,4TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC(=O)CC[C@@H](C(=O)N[C@@H](CCCN)C(=O)O[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3208.0	Standard non polar	33892256
Gamma glutamyl ornithine,4TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC(=O)CC[C@@H](C(=O)N[C@@H](CCCN)C(=O)O[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3656.5	Standard polar	33892256
Gamma glutamyl ornithine,4TBDMS,isomer #3	CC(C)(C)[Si](C)(C)N[C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)N([C@@H](CCCN)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3333.2	Semi standard non polar	33892256
Gamma glutamyl ornithine,4TBDMS,isomer #3	CC(C)(C)[Si](C)(C)N[C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)N([C@@H](CCCN)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3167.1	Standard non polar	33892256
Gamma glutamyl ornithine,4TBDMS,isomer #3	CC(C)(C)[Si](C)(C)N[C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)N([C@@H](CCCN)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3626.2	Standard polar	33892256
Gamma glutamyl ornithine,4TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC(=O)CC[C@H](N)C(=O)N[C@@H](CCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C	3588.2	Semi standard non polar	33892256
Gamma glutamyl ornithine,4TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC(=O)CC[C@H](N)C(=O)N[C@@H](CCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C	3222.2	Standard non polar	33892256
Gamma glutamyl ornithine,4TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC(=O)CC[C@H](N)C(=O)N[C@@H](CCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C	3848.1	Standard polar	33892256
Gamma glutamyl ornithine,4TBDMS,isomer #5	CC(C)(C)[Si](C)(C)NCCC[C@@H](C(=O)O[Si](C)(C)C(C)(C)C)N(C(=O)[C@@H](N)CCC(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3394.0	Semi standard non polar	33892256
Gamma glutamyl ornithine,4TBDMS,isomer #5	CC(C)(C)[Si](C)(C)NCCC[C@@H](C(=O)O[Si](C)(C)C(C)(C)C)N(C(=O)[C@@H](N)CCC(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3193.6	Standard non polar	33892256
Gamma glutamyl ornithine,4TBDMS,isomer #5	CC(C)(C)[Si](C)(C)NCCC[C@@H](C(=O)O[Si](C)(C)C(C)(C)C)N(C(=O)[C@@H](N)CCC(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3700.3	Standard polar	33892256
Gamma glutamyl ornithine,4TBDMS,isomer #6	CC(C)(C)[Si](C)(C)N[C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)N[C@@H](CCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O	3626.3	Semi standard non polar	33892256
Gamma glutamyl ornithine,4TBDMS,isomer #6	CC(C)(C)[Si](C)(C)N[C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)N[C@@H](CCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O	3277.7	Standard non polar	33892256
Gamma glutamyl ornithine,4TBDMS,isomer #6	CC(C)(C)[Si](C)(C)N[C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)N[C@@H](CCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O	3523.9	Standard polar	33892256
Gamma glutamyl ornithine,4TBDMS,isomer #7	CC(C)(C)[Si](C)(C)NCCC[C@@H](C(=O)O)N(C(=O)[C@H](CCC(=O)O[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3462.9	Semi standard non polar	33892256
Gamma glutamyl ornithine,4TBDMS,isomer #7	CC(C)(C)[Si](C)(C)NCCC[C@@H](C(=O)O)N(C(=O)[C@H](CCC(=O)O[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3213.3	Standard non polar	33892256
Gamma glutamyl ornithine,4TBDMS,isomer #7	CC(C)(C)[Si](C)(C)NCCC[C@@H](C(=O)O)N(C(=O)[C@H](CCC(=O)O[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3420.4	Standard polar	33892256
Gamma glutamyl ornithine,4TBDMS,isomer #8	CC(C)(C)[Si](C)(C)NCCC[C@H](NC(=O)[C@H](CCC(=O)O[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O	3659.4	Semi standard non polar	33892256
Gamma glutamyl ornithine,4TBDMS,isomer #8	CC(C)(C)[Si](C)(C)NCCC[C@H](NC(=O)[C@H](CCC(=O)O[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O	3284.5	Standard non polar	33892256
Gamma glutamyl ornithine,4TBDMS,isomer #8	CC(C)(C)[Si](C)(C)NCCC[C@H](NC(=O)[C@H](CCC(=O)O[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O	3477.8	Standard polar	33892256
Gamma glutamyl ornithine,4TBDMS,isomer #9	CC(C)(C)[Si](C)(C)OC(=O)CC[C@@H](C(=O)N([C@@H](CCCN)C(=O)O)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3484.2	Semi standard non polar	33892256
Gamma glutamyl ornithine,4TBDMS,isomer #9	CC(C)(C)[Si](C)(C)OC(=O)CC[C@@H](C(=O)N([C@@H](CCCN)C(=O)O)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3227.9	Standard non polar	33892256
Gamma glutamyl ornithine,4TBDMS,isomer #9	CC(C)(C)[Si](C)(C)OC(=O)CC[C@@H](C(=O)N([C@@H](CCCN)C(=O)O)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3636.4	Standard polar	33892256
Gamma glutamyl ornithine,5TBDMS,isomer #1	CC(C)(C)[Si](C)(C)N[C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)N[C@@H](CCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C	3813.8	Semi standard non polar	33892256
Gamma glutamyl ornithine,5TBDMS,isomer #1	CC(C)(C)[Si](C)(C)N[C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)N[C@@H](CCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C	3405.6	Standard non polar	33892256
Gamma glutamyl ornithine,5TBDMS,isomer #1	CC(C)(C)[Si](C)(C)N[C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)N[C@@H](CCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C	3376.1	Standard polar	33892256
Gamma glutamyl ornithine,5TBDMS,isomer #10	CC(C)(C)[Si](C)(C)N[C@@H](CCC(=O)O)C(=O)N([C@@H](CCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3793.5	Semi standard non polar	33892256
Gamma glutamyl ornithine,5TBDMS,isomer #10	CC(C)(C)[Si](C)(C)N[C@@H](CCC(=O)O)C(=O)N([C@@H](CCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3409.0	Standard non polar	33892256
Gamma glutamyl ornithine,5TBDMS,isomer #10	CC(C)(C)[Si](C)(C)N[C@@H](CCC(=O)O)C(=O)N([C@@H](CCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3373.8	Standard polar	33892256
Gamma glutamyl ornithine,5TBDMS,isomer #11	CC(C)(C)[Si](C)(C)NCCC[C@@H](C(=O)O[Si](C)(C)C(C)(C)C)N(C(=O)[C@H](CCC(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3808.7	Semi standard non polar	33892256
Gamma glutamyl ornithine,5TBDMS,isomer #11	CC(C)(C)[Si](C)(C)NCCC[C@@H](C(=O)O[Si](C)(C)C(C)(C)C)N(C(=O)[C@H](CCC(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3425.5	Standard non polar	33892256
Gamma glutamyl ornithine,5TBDMS,isomer #11	CC(C)(C)[Si](C)(C)NCCC[C@@H](C(=O)O[Si](C)(C)C(C)(C)C)N(C(=O)[C@H](CCC(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3336.9	Standard polar	33892256
Gamma glutamyl ornithine,5TBDMS,isomer #12	CC(C)(C)[Si](C)(C)N(C(=O)[C@H](CCC(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[C@@H](CCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O	3917.0	Semi standard non polar	33892256
Gamma glutamyl ornithine,5TBDMS,isomer #12	CC(C)(C)[Si](C)(C)N(C(=O)[C@H](CCC(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[C@@H](CCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O	3480.3	Standard non polar	33892256
Gamma glutamyl ornithine,5TBDMS,isomer #12	CC(C)(C)[Si](C)(C)N(C(=O)[C@H](CCC(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[C@@H](CCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O	3429.7	Standard polar	33892256
Gamma glutamyl ornithine,5TBDMS,isomer #2	CC(C)(C)[Si](C)(C)NCCC[C@@H](C(=O)O[Si](C)(C)C(C)(C)C)N(C(=O)[C@H](CCC(=O)O[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3604.7	Semi standard non polar	33892256
Gamma glutamyl ornithine,5TBDMS,isomer #2	CC(C)(C)[Si](C)(C)NCCC[C@@H](C(=O)O[Si](C)(C)C(C)(C)C)N(C(=O)[C@H](CCC(=O)O[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3365.8	Standard non polar	33892256
Gamma glutamyl ornithine,5TBDMS,isomer #2	CC(C)(C)[Si](C)(C)NCCC[C@@H](C(=O)O[Si](C)(C)C(C)(C)C)N(C(=O)[C@H](CCC(=O)O[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3307.0	Standard polar	33892256
Gamma glutamyl ornithine,5TBDMS,isomer #3	CC(C)(C)[Si](C)(C)NCCC[C@H](NC(=O)[C@H](CCC(=O)O[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C	3832.3	Semi standard non polar	33892256
Gamma glutamyl ornithine,5TBDMS,isomer #3	CC(C)(C)[Si](C)(C)NCCC[C@H](NC(=O)[C@H](CCC(=O)O[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C	3421.4	Standard non polar	33892256
Gamma glutamyl ornithine,5TBDMS,isomer #3	CC(C)(C)[Si](C)(C)NCCC[C@H](NC(=O)[C@H](CCC(=O)O[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C	3323.1	Standard polar	33892256
Gamma glutamyl ornithine,5TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC(=O)CC[C@@H](C(=O)N([C@@H](CCCN)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3716.1	Semi standard non polar	33892256
Gamma glutamyl ornithine,5TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC(=O)CC[C@@H](C(=O)N([C@@H](CCCN)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3390.8	Standard non polar	33892256
Gamma glutamyl ornithine,5TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC(=O)CC[C@@H](C(=O)N([C@@H](CCCN)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3568.3	Standard polar	33892256
Gamma glutamyl ornithine,5TBDMS,isomer #5	CC(C)(C)[Si](C)(C)OC(=O)CC[C@H](N)C(=O)N([C@@H](CCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3773.5	Semi standard non polar	33892256
Gamma glutamyl ornithine,5TBDMS,isomer #5	CC(C)(C)[Si](C)(C)OC(=O)CC[C@H](N)C(=O)N([C@@H](CCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3402.3	Standard non polar	33892256
Gamma glutamyl ornithine,5TBDMS,isomer #5	CC(C)(C)[Si](C)(C)OC(=O)CC[C@H](N)C(=O)N([C@@H](CCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3671.4	Standard polar	33892256
Gamma glutamyl ornithine,5TBDMS,isomer #6	CC(C)(C)[Si](C)(C)OC(=O)CC[C@@H](C(=O)N[C@@H](CCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3982.4	Semi standard non polar	33892256
Gamma glutamyl ornithine,5TBDMS,isomer #6	CC(C)(C)[Si](C)(C)OC(=O)CC[C@@H](C(=O)N[C@@H](CCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3478.5	Standard non polar	33892256
Gamma glutamyl ornithine,5TBDMS,isomer #6	CC(C)(C)[Si](C)(C)OC(=O)CC[C@@H](C(=O)N[C@@H](CCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3414.9	Standard polar	33892256
Gamma glutamyl ornithine,5TBDMS,isomer #7	CC(C)(C)[Si](C)(C)N[C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)N([C@@H](CCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O)[Si](C)(C)C(C)(C)C	3806.5	Semi standard non polar	33892256
Gamma glutamyl ornithine,5TBDMS,isomer #7	CC(C)(C)[Si](C)(C)N[C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)N([C@@H](CCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O)[Si](C)(C)C(C)(C)C	3419.6	Standard non polar	33892256
Gamma glutamyl ornithine,5TBDMS,isomer #7	CC(C)(C)[Si](C)(C)N[C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)N([C@@H](CCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O)[Si](C)(C)C(C)(C)C	3387.8	Standard polar	33892256
Gamma glutamyl ornithine,5TBDMS,isomer #8	CC(C)(C)[Si](C)(C)NCCC[C@@H](C(=O)O)N(C(=O)[C@H](CCC(=O)O[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3823.6	Semi standard non polar	33892256
Gamma glutamyl ornithine,5TBDMS,isomer #8	CC(C)(C)[Si](C)(C)NCCC[C@@H](C(=O)O)N(C(=O)[C@H](CCC(=O)O[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3440.0	Standard non polar	33892256
Gamma glutamyl ornithine,5TBDMS,isomer #8	CC(C)(C)[Si](C)(C)NCCC[C@@H](C(=O)O)N(C(=O)[C@H](CCC(=O)O[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3350.9	Standard polar	33892256
Gamma glutamyl ornithine,5TBDMS,isomer #9	CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)NC(=O)[C@H](CCC(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3957.7	Semi standard non polar	33892256
Gamma glutamyl ornithine,5TBDMS,isomer #9	CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)NC(=O)[C@H](CCC(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3454.5	Standard non polar	33892256
Gamma glutamyl ornithine,5TBDMS,isomer #9	CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)NC(=O)[C@H](CCC(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3378.7	Standard polar	33892256

Spectra

GC-MS Spectra

Spectrum Type	Description	Splash Key	Deposition Date	Source	View
Predicted GC-MS	Predicted GC-MS Spectrum - Gamma glutamyl ornithine GC-MS (Non-derivatized) - 70eV, Positive	splash10-0f89-6930000000-44b6d31b07122a45b62f	2017-09-01	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Gamma glutamyl ornithine GC-MS (2 TMS) - 70eV, Positive	splash10-00e9-9212000000-57e605b119a53fc47b9f	2017-10-06	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Gamma glutamyl ornithine GC-MS (Non-derivatized) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Gamma glutamyl ornithine GC-MS (Non-derivatized) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum

MS/MS Spectra

Spectrum Type	Description	Splash Key	Deposition Date	Source	View
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Gamma glutamyl ornithine 10V, Positive-QTOF	splash10-002g-0390000000-1d467b0ee2b3fa123008	2017-09-01	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Gamma glutamyl ornithine 20V, Positive-QTOF	splash10-0fri-7950000000-bdebd6eb6fad86bd74ef	2017-09-01	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Gamma glutamyl ornithine 40V, Positive-QTOF	splash10-0a4i-9100000000-10c184672ff050c9bbb9	2017-09-01	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Gamma glutamyl ornithine 10V, Negative-QTOF	splash10-03di-0190000000-e62e9ba6d739e19268ea	2017-09-01	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Gamma glutamyl ornithine 20V, Negative-QTOF	splash10-03ym-1970000000-034e25bffee02b07fadf	2017-09-01	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Gamma glutamyl ornithine 40V, Negative-QTOF	splash10-01sr-6900000000-78e5f7834f78fe062046	2017-09-01	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Gamma glutamyl ornithine 10V, Positive-QTOF	splash10-02ai-0950000000-a82e7c8311462a5501fa	2021-09-22	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Gamma glutamyl ornithine 20V, Positive-QTOF	splash10-0gc0-4940000000-4e81a972a64d9a0e24a7	2021-09-22	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Gamma glutamyl ornithine 40V, Positive-QTOF	splash10-052r-9200000000-d5cc6abb83095e0cc21c	2021-09-22	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Gamma glutamyl ornithine 10V, Negative-QTOF	splash10-03dl-0090000000-b61c7a61eafca99517d5	2021-09-22	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Gamma glutamyl ornithine 20V, Negative-QTOF	splash10-01u3-1940000000-c7d414af9c1ec2e0ac6e	2021-09-22	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Gamma glutamyl ornithine 40V, Negative-QTOF	splash10-000x-9700000000-5ab3df51fe07b0445b7f	2021-09-22	Wishart Lab	View Spectrum

NMR Spectra

Spectrum Type	Description	Deposition Date	Source	View
Predicted 1D NMR	¹H NMR Spectrum (1D, 100 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 100 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 1000 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 1000 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 200 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 200 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 300 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 300 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 400 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 400 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 500 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 500 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 600 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 600 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 700 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 700 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 800 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 800 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 900 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 900 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum

Biological Properties

Cellular Locations

Not Available

Biospecimen Locations

Not Available

Tissue Locations

Not Available

Pathways

Not Available

Name	SMPDB/PathBank	KEGG

Normal Concentrations

Not Available

Abnormal Concentrations

Not Available

Associated Disorders and Diseases

Disease References

None

Associated OMIM IDs

None

External Links

DrugBank ID

Not Available

Phenol Explorer Compound ID

Not Available

FooDB ID

FDB112178

KNApSAcK ID

Not Available

Chemspider ID

164354

KEGG Compound ID

Not Available

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Not Available

METLIN ID

6571

PubChem Compound

189156

PDB ID

Not Available

ChEBI ID

173862

Food Biomarker Ontology

Not Available

VMH ID

Not Available

MarkerDB ID

Not Available

Good Scents ID

Not Available

References

Synthesis Reference

Not Available

Material Safety Data Sheet (MSDS)

Not Available

General References

Roesel RA, Coryell ME, Blankenship PR, Hommes FA: Gamma-glutamylornithine excretion in patients with hyperornithinemia. Clin Chim Acta. 1984 Jul 16;140(2):133-8. [PubMed:6547887 ]
Lou MF: Isolation and identification of L-beta-aspartyl-Llysine and L-gamma-glutamyl-L-ornithine from normal human urine. Biochemistry. 1975 Jul 29;14(15):3503-8. [PubMed:1148212 ]

Showing metabocard for Gamma glutamyl ornithine (HMDB0002248)

MOL for HMDB0002248 (Gamma glutamyl ornithine)

3D MOL for HMDB0002248 (Gamma glutamyl ornithine)

3D SDF for HMDB0002248 (Gamma glutamyl ornithine)

3D-SDF for HMDB0002248 (Gamma glutamyl ornithine)

PDB for HMDB0002248 (Gamma glutamyl ornithine)

3D PDB for HMDB0002248 (Gamma glutamyl ornithine)

SMILES for HMDB0002248 (Gamma glutamyl ornithine)

INCHI for HMDB0002248 (Gamma glutamyl ornithine)

Structure for HMDB0002248 (Gamma glutamyl ornithine)

3D Structure for HMDB0002248 (Gamma glutamyl ornithine)

Predicted Collision Cross Sections

Predicted Kovats Retention Indices

Underivatized

Derivatized

GC-MS Spectra

MS/MS Spectra

NMR Spectra