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Record Information

Version

5.0

Status

Expected but not Quantified

Creation Date

2012-09-06 21:03:16 UTC

Update Date

2021-09-14 15:37:03 UTC

HMDB ID

HMDB0028989

Secondary Accession Numbers

HMDB28989

Metabolite Identification

Common Name

Phenylalanylarginine

Description

Phenylalanylarginine is a dipeptide composed of phenylalanine and arginine. It is an incomplete breakdown product of protein digestion or protein catabolism. Dipeptides are organic compounds containing a sequence of exactly two alpha-amino acids joined by a peptide bond. Some dipeptides are known to have physiological or cell-signalling effects although most are simply short-lived intermediates on their way to specific amino acid degradation pathways following further proteolysis.

Structure

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

HMDB0028989
     RDKit          3D
Phenylalanylarginine
 46 46  0  0  0  0  0  0  0  0999 V2000
    6.8403    1.5458   -0.4643 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.4099    0.7781    0.4735 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5149    1.1343    1.8410 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.8179   -0.4516    0.1308 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.3862   -0.6279    0.4995 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724    0.2832   -0.3295 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1190    0.3920   -0.1599 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2344   -0.7867   -0.3126 C   0  0  2  0  0  0  0  0  0  0  0  0
   -0.1528   -0.1993   -0.1887 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9714   -0.3440   -1.3279 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5764   -0.9154   -2.3621 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3644    0.2342   -1.2298 C   0  0  1  0  0  0  0  0  0  0  0  0
   -3.0124   -0.0193   -2.4885 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0236   -0.4695   -0.0785 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4013   -0.0378    0.1782 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4328   -0.6965   -0.4664 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7516   -0.3764   -0.2990 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0870    0.6514    0.5509 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0667    1.3358    1.2165 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7541    0.9882    1.0251 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2156   -1.7756    0.7862 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0781   -2.4037    0.9020 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1754   -2.1178    1.6719 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7602    1.2781   -1.4665 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9446    0.4821    2.5129 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.1466    2.0717    2.1475 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.2783   -1.2347   -0.3497 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2477   -0.4177    1.5632 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2174   -1.7030    0.2908 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9729    1.3564   -0.2257 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7515    0.1063   -1.4413 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7804    1.1781   -0.9317 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8751    0.9596    0.8056 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3740   -1.2414   -1.2917 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3837    0.2522    0.7035 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2415    1.3151   -1.0284 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4205    0.3115   -3.2824 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8808    0.5877   -2.5160 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3915   -0.3024    0.8163 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0184   -1.5589   -0.3076 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1850   -1.5181   -1.1476 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.5767   -0.8858   -0.7996 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.1008    0.9464    0.7214 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3047    2.1451    1.8881 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9617    1.5137    1.5370 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3467   -1.7634    2.5827 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  3
  2  3  1  0
  2  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  9 10  1  0
 10 11  2  0
 10 12  1  0
 12 13  1  0
 12 14  1  0
 14 15  1  0
 15 16  2  0
 16 17  1  0
 17 18  2  0
 18 19  1  0
 19 20  2  0
  8 21  1  0
 21 22  2  0
 21 23  1  0
 20 15  1  0
  1 24  1  0
  3 25  1  0
  3 26  1  0
  4 27  1  0
  5 28  1  0
  5 29  1  0
  6 30  1  0
  6 31  1  0
  7 32  1  0
  7 33  1  0
  8 34  1  6
  9 35  1  0
 12 36  1  1
 13 37  1  0
 13 38  1  0
 14 39  1  0
 14 40  1  0
 16 41  1  0
 17 42  1  0
 18 43  1  0
 19 44  1  0
 20 45  1  0
 23 46  1  0
M  END

  Mrv1652304062014042D          

 23 23  0  0  0  0            999 V2000
10001.8001 9999.8034    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
10001.085410000.2157    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
10000.3730 9999.8034    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
 9999.659010000.2157    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 9998.9455 9999.8034    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
 9998.230210000.2157    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 9998.9455 9998.9797    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
 9999.659010001.0394    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
10001.085410001.0394    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 9997.5187 9999.8043    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 9996.804210000.2167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 9996.0897 9999.8042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 9996.0896 9998.9792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 9996.8041 9998.5667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 9997.5187 9998.9793    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
10002.512010000.2149    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
10001.800110001.4513    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
10000.373010001.4513    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
10003.2266 9999.8027    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
10003.940910000.2156    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
10004.6556 9999.8034    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
10004.6560 9998.9784    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
10005.369810000.2163    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  2  9  1  6  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  4  8  2  0  0  0  0
  5  6  1  0  0  0  0
  5  7  1  1  0  0  0
 10 11  2  0  0  0  0
 11 12  1  0  0  0  0
 12 13  2  0  0  0  0
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
 15 10  1  0  0  0  0
  6 10  1  0  0  0  0
  1 16  1  0  0  0  0
  9 17  1  0  0  0  0
  9 18  2  0  0  0  0
 16 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  2  0  0  0  0
 21 23  1  0  0  0  0
M  END
> <DATABASE_ID>
HMDB0028989

> <DATABASE_NAME>
hmdb

> <SMILES>
N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CCCNC(N)=N)C(O)=O

> <INCHI_IDENTIFIER>
InChI=1S/C15H23N5O3/c16-11(9-10-5-2-1-3-6-10)13(21)20-12(14(22)23)7-4-8-19-15(17)18/h1-3,5-6,11-12H,4,7-9,16H2,(H,20,21)(H,22,23)(H4,17,18,19)/t11-,12-/m0/s1

> <INCHI_KEY>
OZILORBBPKKGRI-RYUDHWBXSA-N

> <FORMULA>
C15H23N5O3

> <MOLECULAR_WEIGHT>
321.381

> <EXACT_MASS>
321.180089621

> <JCHEM_ACCEPTOR_COUNT>
7

> <JCHEM_ATOM_COUNT>
46

> <JCHEM_AVERAGE_POLARIZABILITY>
34.31545085948953

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
6

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
(2S)-2-[(2S)-2-amino-3-phenylpropanamido]-5-carbamimidamidopentanoic acid

> <ALOGPS_LOGP>
-3.10

> <JCHEM_LOGP>
-2.0215927482962837

> <ALOGPS_LOGS>
-3.29

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
1

> <JCHEM_PHYSIOLOGICAL_CHARGE>
1

> <JCHEM_PKA>
13.76208996525899

> <JCHEM_PKA_STRONGEST_ACIDIC>
3.6471478445988654

> <JCHEM_PKA_STRONGEST_BASIC>
12.09174309352203

> <JCHEM_POLAR_SURFACE_AREA>
154.32

> <JCHEM_REFRACTIVITY>
95.83950000000002

> <JCHEM_ROTATABLE_BOND_COUNT>
9

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
1.66e-01 g/l

> <JCHEM_TRADITIONAL_IUPAC>
(2S)-2-[(2S)-2-amino-3-phenylpropanamido]-5-carbamimidamidopentanoic acid

> <JCHEM_VEBER_RULE>
0

$$$$

HMDB0028989
     RDKit          3D
Phenylalanylarginine
 46 46  0  0  0  0  0  0  0  0999 V2000
    6.8403    1.5458   -0.4643 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.4099    0.7781    0.4735 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5149    1.1343    1.8410 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.8179   -0.4516    0.1308 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.3862   -0.6279    0.4995 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724    0.2832   -0.3295 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1190    0.3920   -0.1599 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2344   -0.7867   -0.3126 C   0  0  2  0  0  0  0  0  0  0  0  0
   -0.1528   -0.1993   -0.1887 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9714   -0.3440   -1.3279 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5764   -0.9154   -2.3621 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3644    0.2342   -1.2298 C   0  0  1  0  0  0  0  0  0  0  0  0
   -3.0124   -0.0193   -2.4885 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0236   -0.4695   -0.0785 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4013   -0.0378    0.1782 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4328   -0.6965   -0.4664 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7516   -0.3764   -0.2990 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0870    0.6514    0.5509 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0667    1.3358    1.2165 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7541    0.9882    1.0251 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2156   -1.7756    0.7862 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0781   -2.4037    0.9020 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1754   -2.1178    1.6719 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7602    1.2781   -1.4665 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9446    0.4821    2.5129 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.1466    2.0717    2.1475 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.2783   -1.2347   -0.3497 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2477   -0.4177    1.5632 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2174   -1.7030    0.2908 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9729    1.3564   -0.2257 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7515    0.1063   -1.4413 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7804    1.1781   -0.9317 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8751    0.9596    0.8056 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3740   -1.2414   -1.2917 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3837    0.2522    0.7035 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2415    1.3151   -1.0284 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4205    0.3115   -3.2824 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8808    0.5877   -2.5160 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3915   -0.3024    0.8163 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0184   -1.5589   -0.3076 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1850   -1.5181   -1.1476 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.5767   -0.8858   -0.7996 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.1008    0.9464    0.7214 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3047    2.1451    1.8881 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9617    1.5137    1.5370 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3467   -1.7634    2.5827 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  3
  2  3  1  0
  2  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  9 10  1  0
 10 11  2  0
 10 12  1  0
 12 13  1  0
 12 14  1  0
 14 15  1  0
 15 16  2  0
 16 17  1  0
 17 18  2  0
 18 19  1  0
 19 20  2  0
  8 21  1  0
 21 22  2  0
 21 23  1  0
 20 15  1  0
  1 24  1  0
  3 25  1  0
  3 26  1  0
  4 27  1  0
  5 28  1  0
  5 29  1  0
  6 30  1  0
  6 31  1  0
  7 32  1  0
  7 33  1  0
  8 34  1  6
  9 35  1  0
 12 36  1  1
 13 37  1  0
 13 38  1  0
 14 39  1  0
 14 40  1  0
 16 41  1  0
 17 42  1  0
 18 43  1  0
 19 44  1  0
 20 45  1  0
 23 46  1  0
M  END

HEADER    PROTEIN                                 06-APR-20   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   06-APR-20         0                                  
HETATM    1  C   UNK     0    8670.0278666.300   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0    8668.6938667.069   0.000  0.00  0.00           C+0
HETATM    3  N   UNK     0    8667.3638666.300   0.000  0.00  0.00           N+0
HETATM    4  C   UNK     0    8666.0308667.069   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0    8664.6988666.300   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0    8663.3638667.069   0.000  0.00  0.00           C+0
HETATM    7  N   UNK     0    8664.6988664.762   0.000  0.00  0.00           N+0
HETATM    8  O   UNK     0    8666.0308668.607   0.000  0.00  0.00           O+0
HETATM    9  C   UNK     0    8668.6938668.607   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0    8662.0358666.301   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0    8660.7018667.071   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0    8659.3678666.301   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0    8659.3678664.761   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0    8660.7018663.991   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0    8662.0358664.761   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0    8671.3568667.068   0.000  0.00  0.00           C+0
HETATM   17  O   UNK     0    8670.0278669.376   0.000  0.00  0.00           O+0
HETATM   18  O   UNK     0    8667.3638669.376   0.000  0.00  0.00           O+0
HETATM   19  C   UNK     0    8672.6908666.298   0.000  0.00  0.00           C+0
HETATM   20  N   UNK     0    8674.0238667.069   0.000  0.00  0.00           N+0
HETATM   21  C   UNK     0    8675.3578666.300   0.000  0.00  0.00           C+0
HETATM   22  N   UNK     0    8675.3588664.760   0.000  0.00  0.00           N+0
HETATM   23  N   UNK     0    8676.6908667.070   0.000  0.00  0.00           N+0
CONECT    1    2   16                                                       
CONECT    2    1    3    9                                                  
CONECT    3    2    4                                                       
CONECT    4    3    5    8                                                  
CONECT    5    4    6    7                                                  
CONECT    6    5   10                                                       
CONECT    7    5                                                            
CONECT    8    4                                                            
CONECT    9    2   17   18                                                  
CONECT   10   11   15    6                                                  
CONECT   11   10   12                                                       
CONECT   12   11   13                                                       
CONECT   13   12   14                                                       
CONECT   14   13   15                                                       
CONECT   15   14   10                                                       
CONECT   16    1   19                                                       
CONECT   17    9                                                            
CONECT   18    9                                                            
CONECT   19   16   20                                                       
CONECT   20   19   21                                                       
CONECT   21   20   22   23                                                  
CONECT   22   21                                                            
CONECT   23   21                                                            
MASTER        0    0    0    0    0    0    0    0   23    0   46    0
END

COMPND    HMDB0028989
HETATM    1  N1  UNL     1       6.840   1.546  -0.464  1.00  0.00           N  
HETATM    2  C1  UNL     1       6.410   0.778   0.474  1.00  0.00           C  
HETATM    3  N2  UNL     1       6.515   1.134   1.841  1.00  0.00           N  
HETATM    4  N3  UNL     1       5.818  -0.452   0.131  1.00  0.00           N  
HETATM    5  C2  UNL     1       4.386  -0.628   0.500  1.00  0.00           C  
HETATM    6  C3  UNL     1       3.572   0.283  -0.330  1.00  0.00           C  
HETATM    7  C4  UNL     1       2.119   0.392  -0.160  1.00  0.00           C  
HETATM    8  C5  UNL     1       1.234  -0.787  -0.313  1.00  0.00           C  
HETATM    9  N4  UNL     1      -0.153  -0.199  -0.189  1.00  0.00           N  
HETATM   10  C6  UNL     1      -0.971  -0.344  -1.328  1.00  0.00           C  
HETATM   11  O1  UNL     1      -0.576  -0.915  -2.362  1.00  0.00           O  
HETATM   12  C7  UNL     1      -2.364   0.234  -1.230  1.00  0.00           C  
HETATM   13  N5  UNL     1      -3.012  -0.019  -2.488  1.00  0.00           N  
HETATM   14  C8  UNL     1      -3.024  -0.469  -0.078  1.00  0.00           C  
HETATM   15  C9  UNL     1      -4.401  -0.038   0.178  1.00  0.00           C  
HETATM   16  C10 UNL     1      -5.433  -0.696  -0.466  1.00  0.00           C  
HETATM   17  C11 UNL     1      -6.752  -0.376  -0.299  1.00  0.00           C  
HETATM   18  C12 UNL     1      -7.087   0.651   0.551  1.00  0.00           C  
HETATM   19  C13 UNL     1      -6.067   1.336   1.217  1.00  0.00           C  
HETATM   20  C14 UNL     1      -4.754   0.988   1.025  1.00  0.00           C  
HETATM   21  C15 UNL     1       1.216  -1.776   0.786  1.00  0.00           C  
HETATM   22  O2  UNL     1       0.078  -2.404   0.902  1.00  0.00           O  
HETATM   23  O3  UNL     1       2.175  -2.118   1.672  1.00  0.00           O  
HETATM   24  H1  UNL     1       6.760   1.278  -1.467  1.00  0.00           H  
HETATM   25  H2  UNL     1       6.945   0.482   2.513  1.00  0.00           H  
HETATM   26  H3  UNL     1       6.147   2.072   2.147  1.00  0.00           H  
HETATM   27  H4  UNL     1       6.278  -1.235  -0.350  1.00  0.00           H  
HETATM   28  H5  UNL     1       4.248  -0.418   1.563  1.00  0.00           H  
HETATM   29  H6  UNL     1       4.217  -1.703   0.291  1.00  0.00           H  
HETATM   30  H7  UNL     1       3.973   1.356  -0.226  1.00  0.00           H  
HETATM   31  H8  UNL     1       3.752   0.106  -1.441  1.00  0.00           H  
HETATM   32  H9  UNL     1       1.780   1.178  -0.932  1.00  0.00           H  
HETATM   33  H10 UNL     1       1.875   0.960   0.806  1.00  0.00           H  
HETATM   34  H11 UNL     1       1.374  -1.241  -1.292  1.00  0.00           H  
HETATM   35  H12 UNL     1      -0.384   0.252   0.703  1.00  0.00           H  
HETATM   36  H13 UNL     1      -2.241   1.315  -1.028  1.00  0.00           H  
HETATM   37  H14 UNL     1      -2.420   0.311  -3.282  1.00  0.00           H  
HETATM   38  H15 UNL     1      -3.881   0.588  -2.516  1.00  0.00           H  
HETATM   39  H16 UNL     1      -2.392  -0.302   0.816  1.00  0.00           H  
HETATM   40  H17 UNL     1      -3.018  -1.559  -0.308  1.00  0.00           H  
HETATM   41  H18 UNL     1      -5.185  -1.518  -1.148  1.00  0.00           H  
HETATM   42  H19 UNL     1      -7.577  -0.886  -0.800  1.00  0.00           H  
HETATM   43  H20 UNL     1      -8.101   0.946   0.721  1.00  0.00           H  
HETATM   44  H21 UNL     1      -6.305   2.145   1.888  1.00  0.00           H  
HETATM   45  H22 UNL     1      -3.962   1.514   1.537  1.00  0.00           H  
HETATM   46  H23 UNL     1       2.347  -1.763   2.583  1.00  0.00           H  
CONECT    1    2    2   24
CONECT    2    3    4
CONECT    3   25   26
CONECT    4    5   27
CONECT    5    6   28   29
CONECT    6    7   30   31
CONECT    7    8   32   33
CONECT    8    9   21   34
CONECT    9   10   35
CONECT   10   11   11   12
CONECT   12   13   14   36
CONECT   13   37   38
CONECT   14   15   39   40
CONECT   15   16   16   20
CONECT   16   17   41
CONECT   17   18   18   42
CONECT   18   19   43
CONECT   19   20   20   44
CONECT   20   45
CONECT   21   22   22   23
CONECT   23   46
END

HMDB0028989
     RDKit          3D
Phenylalanylarginine
 46 46  0  0  0  0  0  0  0  0999 V2000
    6.8403    1.5458   -0.4643 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.4099    0.7781    0.4735 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5149    1.1343    1.8410 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.8179   -0.4516    0.1308 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.3862   -0.6279    0.4995 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724    0.2832   -0.3295 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1190    0.3920   -0.1599 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2344   -0.7867   -0.3126 C   0  0  2  0  0  0  0  0  0  0  0  0
   -0.1528   -0.1993   -0.1887 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9714   -0.3440   -1.3279 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5764   -0.9154   -2.3621 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3644    0.2342   -1.2298 C   0  0  1  0  0  0  0  0  0  0  0  0
   -3.0124   -0.0193   -2.4885 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0236   -0.4695   -0.0785 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4013   -0.0378    0.1782 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4328   -0.6965   -0.4664 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7516   -0.3764   -0.2990 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0870    0.6514    0.5509 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0667    1.3358    1.2165 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7541    0.9882    1.0251 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2156   -1.7756    0.7862 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0781   -2.4037    0.9020 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1754   -2.1178    1.6719 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7602    1.2781   -1.4665 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9446    0.4821    2.5129 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.1466    2.0717    2.1475 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.2783   -1.2347   -0.3497 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2477   -0.4177    1.5632 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2174   -1.7030    0.2908 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9729    1.3564   -0.2257 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7515    0.1063   -1.4413 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7804    1.1781   -0.9317 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8751    0.9596    0.8056 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3740   -1.2414   -1.2917 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3837    0.2522    0.7035 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2415    1.3151   -1.0284 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4205    0.3115   -3.2824 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8808    0.5877   -2.5160 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3915   -0.3024    0.8163 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0184   -1.5589   -0.3076 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1850   -1.5181   -1.1476 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.5767   -0.8858   -0.7996 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.1008    0.9464    0.7214 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3047    2.1451    1.8881 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9617    1.5137    1.5370 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3467   -1.7634    2.5827 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  3
  2  3  1  0
  2  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  9 10  1  0
 10 11  2  0
 10 12  1  0
 12 13  1  0
 12 14  1  0
 14 15  1  0
 15 16  2  0
 16 17  1  0
 17 18  2  0
 18 19  1  0
 19 20  2  0
  8 21  1  0
 21 22  2  0
 21 23  1  0
 20 15  1  0
  1 24  1  0
  3 25  1  0
  3 26  1  0
  4 27  1  0
  5 28  1  0
  5 29  1  0
  6 30  1  0
  6 31  1  0
  7 32  1  0
  7 33  1  0
  8 34  1  6
  9 35  1  0
 12 36  1  1
 13 37  1  0
 13 38  1  0
 14 39  1  0
 14 40  1  0
 16 41  1  0
 17 42  1  0
 18 43  1  0
 19 44  1  0
 20 45  1  0
 23 46  1  0
M  END

View in JSmol View NMR Assignments View Stereo Labels

Synonyms

Value	Source
F-R	ChEBI
FR	ChEBI
L-Phe-L-arg	ChEBI
F-R Dipeptide	HMDB
FR Dipeptide	HMDB
L-Phenylalanyl-L-arginine	HMDB
Phe-arg	HMDB
Phenylalanine arginine dipeptide	HMDB
Phenylalanine-arginine dipeptide	HMDB
Phenylalanylarginine, D-arg-L-phe	HMDB
Phenylalanylarginine, all D-isomers	HMDB
Phenylalanylarginine, L-arg-D-phe	HMDB
N2-L-Phenylalanyl-L-arginine	HMDB
N2-Phenylalanylarginine	HMDB
Phenylalanyl-arginine	HMDB
Phenylalanylarginine	HMDB

Chemical Formula

C₁₅H₂₃N₅O₃

Average Molecular Weight

321.381

Monoisotopic Molecular Weight

321.180089621

IUPAC Name

(2S)-2-[(2S)-2-amino-3-phenylpropanamido]-5-carbamimidamidopentanoic acid

Traditional Name

(2S)-2-[(2S)-2-amino-3-phenylpropanamido]-5-carbamimidamidopentanoic acid

CAS Registry Number

1238-09-1

SMILES

N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CCCNC(N)=N)C(O)=O

InChI Identifier

InChI=1S/C15H23N5O3/c16-11(9-10-5-2-1-3-6-10)13(21)20-12(14(22)23)7-4-8-19-15(17)18/h1-3,5-6,11-12H,4,7-9,16H2,(H,20,21)(H,22,23)(H4,17,18,19)/t11-,12-/m0/s1

InChI Key

OZILORBBPKKGRI-RYUDHWBXSA-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
Phenylalanine or derivatives
N-acyl-alpha-amino acid
N-acyl-l-alpha-amino acid
N-acyl-alpha amino acid or derivatives
Alpha-amino acid amide
Alpha-amino acid or derivatives
Amphetamine or derivatives
Aralkylamine
Monocyclic benzene moiety
Fatty amide
Fatty acyl
Benzenoid
Amino acid or derivatives
Carboxamide group
Amino acid
Guanidine
Secondary carboxylic acid amide
Propargyl-type 1,3-dipolar organic compound
Organic 1,3-dipolar compound
Carboximidamide
Monocarboxylic acid or derivatives
Carboxylic acid
Organonitrogen compound
Organic nitrogen compound
Amine
Primary aliphatic amine
Organic oxygen compound
Carbonyl group
Organic oxide
Organooxygen compound
Primary amine
Organopnictogen compound
Hydrocarbon derivative
Aromatic homomonocyclic compound

Molecular Framework

Aromatic homomonocyclic compounds

External Descriptors

dipeptide (CHEBI:73632 )

Ontology

Not Available

Endogenous (HMDB: HMDB0028989)

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	Not Available	Not Available
Boiling Point	Not Available	Not Available
Water Solubility	Not Available	Not Available
LogP	-2.02	Extrapolated

Experimental Chromatographic Properties

Not Available

Predicted Molecular Properties

Property	Value	Source
Water Solubility	0.17 g/L	ALOGPS
logP	-3.1	ALOGPS
logP	-2	ChemAxon
logS	-3.3	ALOGPS
pKa (Strongest Acidic)	3.65	ChemAxon
pKa (Strongest Basic)	12.09	ChemAxon
Physiological Charge	1	ChemAxon
Hydrogen Acceptor Count	7	ChemAxon
Hydrogen Donor Count	6	ChemAxon
Polar Surface Area	154.32 Å²	ChemAxon
Rotatable Bond Count	9	ChemAxon
Refractivity	95.84 m³·mol⁻¹	ChemAxon
Polarizability	34.32 Å³	ChemAxon
Number of Rings	1	ChemAxon
Bioavailability	Yes	ChemAxon
Rule of Five	No	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
DeepCCS	[M+H]+	172.985	30932474
DeepCCS	[M-H]-	170.627	30932474
DeepCCS	[M-2H]-	204.475	30932474
DeepCCS	[M+Na]+	179.703	30932474

Predicted Kovats Retention Indices

Underivatized

Metabolite	SMILES	Kovats RI Value	Column Type	Reference
Phenylalanylarginine	N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CCCNC(N)=N)C(O)=O	4332.8	Standard polar	33892256
Phenylalanylarginine	N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CCCNC(N)=N)C(O)=O	2723.6	Standard non polar	33892256
Phenylalanylarginine	N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CCCNC(N)=N)C(O)=O	3426.9	Semi standard non polar	33892256

Derivatized

Derivative Name / Structure	SMILES	Kovats RI Value	Column Type	Reference
Phenylalanylarginine,1TMS,isomer #1	C[Si](C)(C)OC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CC1=CC=CC=C1	3140.8	Semi standard non polar	33892256
Phenylalanylarginine,1TMS,isomer #2	C[Si](C)(C)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O	3241.4	Semi standard non polar	33892256
Phenylalanylarginine,1TMS,isomer #3	C[Si](C)(C)NC(=N)NCCC[C@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)C(=O)O	3312.6	Semi standard non polar	33892256
Phenylalanylarginine,1TMS,isomer #4	C[Si](C)(C)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[C@@H](CCCNC(=N)N)C(=O)O	3134.2	Semi standard non polar	33892256
Phenylalanylarginine,1TMS,isomer #5	C[Si](C)(C)N(CCC[C@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)C(=O)O)C(=N)N	3229.4	Semi standard non polar	33892256
Phenylalanylarginine,1TMS,isomer #6	C[Si](C)(C)N=C(N)NCCC[C@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)C(=O)O	3132.7	Semi standard non polar	33892256
Phenylalanylarginine,2TMS,isomer #1	C[Si](C)(C)NC(=N)NCCC[C@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)C(=O)O[Si](C)(C)C	3263.5	Semi standard non polar	33892256
Phenylalanylarginine,2TMS,isomer #1	C[Si](C)(C)NC(=N)NCCC[C@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)C(=O)O[Si](C)(C)C	2765.5	Standard non polar	33892256
Phenylalanylarginine,2TMS,isomer #10	C[Si](C)(C)N=C(N)NCCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C)C(=O)O	3095.0	Semi standard non polar	33892256
Phenylalanylarginine,2TMS,isomer #10	C[Si](C)(C)N=C(N)NCCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C)C(=O)O	2769.8	Standard non polar	33892256
Phenylalanylarginine,2TMS,isomer #11	C[Si](C)(C)N(C(=N)NCCC[C@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	3305.7	Semi standard non polar	33892256
Phenylalanylarginine,2TMS,isomer #11	C[Si](C)(C)N(C(=N)NCCC[C@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	2922.8	Standard non polar	33892256
Phenylalanylarginine,2TMS,isomer #12	C[Si](C)(C)N=C(NCCC[C@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)C(=O)O)N[Si](C)(C)C	3228.4	Semi standard non polar	33892256
Phenylalanylarginine,2TMS,isomer #12	C[Si](C)(C)N=C(NCCC[C@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)C(=O)O)N[Si](C)(C)C	2678.5	Standard non polar	33892256
Phenylalanylarginine,2TMS,isomer #13	C[Si](C)(C)NC(=N)N(CCC[C@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	3265.8	Semi standard non polar	33892256
Phenylalanylarginine,2TMS,isomer #13	C[Si](C)(C)NC(=N)N(CCC[C@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	2891.3	Standard non polar	33892256
Phenylalanylarginine,2TMS,isomer #14	C[Si](C)(C)NC(=N)NCCC[C@@H](C(=O)O)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C	3234.1	Semi standard non polar	33892256
Phenylalanylarginine,2TMS,isomer #14	C[Si](C)(C)NC(=N)NCCC[C@@H](C(=O)O)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C	2801.9	Standard non polar	33892256
Phenylalanylarginine,2TMS,isomer #15	C[Si](C)(C)N(CCC[C@@H](C(=O)O)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C)C(=N)N	3088.2	Semi standard non polar	33892256
Phenylalanylarginine,2TMS,isomer #15	C[Si](C)(C)N(CCC[C@@H](C(=O)O)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C)C(=N)N	2804.1	Standard non polar	33892256
Phenylalanylarginine,2TMS,isomer #16	C[Si](C)(C)N=C(N)NCCC[C@@H](C(=O)O)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C	3027.7	Semi standard non polar	33892256
Phenylalanylarginine,2TMS,isomer #16	C[Si](C)(C)N=C(N)NCCC[C@@H](C(=O)O)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C	2743.3	Standard non polar	33892256
Phenylalanylarginine,2TMS,isomer #17	C[Si](C)(C)N=C(N)N(CCC[C@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	3126.6	Semi standard non polar	33892256
Phenylalanylarginine,2TMS,isomer #17	C[Si](C)(C)N=C(N)N(CCC[C@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	2708.8	Standard non polar	33892256
Phenylalanylarginine,2TMS,isomer #2	C[Si](C)(C)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O[Si](C)(C)C	3173.0	Semi standard non polar	33892256
Phenylalanylarginine,2TMS,isomer #2	C[Si](C)(C)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O[Si](C)(C)C	2737.1	Standard non polar	33892256
Phenylalanylarginine,2TMS,isomer #3	C[Si](C)(C)OC(=O)[C@H](CCCN(C(=N)N)[Si](C)(C)C)NC(=O)[C@@H](N)CC1=CC=CC=C1	3121.8	Semi standard non polar	33892256
Phenylalanylarginine,2TMS,isomer #3	C[Si](C)(C)OC(=O)[C@H](CCCN(C(=N)N)[Si](C)(C)C)NC(=O)[C@@H](N)CC1=CC=CC=C1	2757.0	Standard non polar	33892256
Phenylalanylarginine,2TMS,isomer #4	C[Si](C)(C)N=C(N)NCCC[C@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)C(=O)O[Si](C)(C)C	3022.7	Semi standard non polar	33892256
Phenylalanylarginine,2TMS,isomer #4	C[Si](C)(C)N=C(N)NCCC[C@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)C(=O)O[Si](C)(C)C	2649.4	Standard non polar	33892256
Phenylalanylarginine,2TMS,isomer #5	C[Si](C)(C)OC(=O)[C@H](CCCNC(=N)N)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C	3056.9	Semi standard non polar	33892256
Phenylalanylarginine,2TMS,isomer #5	C[Si](C)(C)OC(=O)[C@H](CCCNC(=N)N)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C	2677.8	Standard non polar	33892256
Phenylalanylarginine,2TMS,isomer #6	C[Si](C)(C)NC(=N)NCCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C)C(=O)O	3339.9	Semi standard non polar	33892256
Phenylalanylarginine,2TMS,isomer #6	C[Si](C)(C)NC(=N)NCCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C)C(=O)O	2828.1	Standard non polar	33892256
Phenylalanylarginine,2TMS,isomer #7	C[Si](C)(C)N([C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[Si](C)(C)C	3342.3	Semi standard non polar	33892256
Phenylalanylarginine,2TMS,isomer #7	C[Si](C)(C)N([C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[Si](C)(C)C	2831.0	Standard non polar	33892256
Phenylalanylarginine,2TMS,isomer #8	C[Si](C)(C)N[C@@H](CC1=CC=CC=C1)C(=O)N([C@@H](CCCNC(=N)N)C(=O)O)[Si](C)(C)C	3162.7	Semi standard non polar	33892256
Phenylalanylarginine,2TMS,isomer #8	C[Si](C)(C)N[C@@H](CC1=CC=CC=C1)C(=O)N([C@@H](CCCNC(=N)N)C(=O)O)[Si](C)(C)C	2752.5	Standard non polar	33892256
Phenylalanylarginine,2TMS,isomer #9	C[Si](C)(C)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CCCN(C(=N)N)[Si](C)(C)C)C(=O)O	3201.5	Semi standard non polar	33892256
Phenylalanylarginine,2TMS,isomer #9	C[Si](C)(C)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CCCN(C(=N)N)[Si](C)(C)C)C(=O)O	2854.2	Standard non polar	33892256
Phenylalanylarginine,3TMS,isomer #1	C[Si](C)(C)NC(=N)NCCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C)C(=O)O[Si](C)(C)C	3240.3	Semi standard non polar	33892256
Phenylalanylarginine,3TMS,isomer #1	C[Si](C)(C)NC(=N)NCCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C)C(=O)O[Si](C)(C)C	2846.3	Standard non polar	33892256
Phenylalanylarginine,3TMS,isomer #10	C[Si](C)(C)N=C(N)N(CCC[C@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C	3024.9	Semi standard non polar	33892256
Phenylalanylarginine,3TMS,isomer #10	C[Si](C)(C)N=C(N)N(CCC[C@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C	2576.8	Standard non polar	33892256
Phenylalanylarginine,3TMS,isomer #11	C[Si](C)(C)OC(=O)[C@H](CCCN(C(=N)N)[Si](C)(C)C)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C	3022.3	Semi standard non polar	33892256
Phenylalanylarginine,3TMS,isomer #11	C[Si](C)(C)OC(=O)[C@H](CCCN(C(=N)N)[Si](C)(C)C)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C	2785.1	Standard non polar	33892256
Phenylalanylarginine,3TMS,isomer #12	C[Si](C)(C)N=C(N)NCCC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C	2937.8	Semi standard non polar	33892256
Phenylalanylarginine,3TMS,isomer #12	C[Si](C)(C)N=C(N)NCCC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C	2699.0	Standard non polar	33892256
Phenylalanylarginine,3TMS,isomer #13	C[Si](C)(C)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)C(=O)O	3255.2	Semi standard non polar	33892256
Phenylalanylarginine,3TMS,isomer #13	C[Si](C)(C)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)C(=O)O	2996.8	Standard non polar	33892256
Phenylalanylarginine,3TMS,isomer #14	C[Si](C)(C)N=C(NCCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C)C(=O)O)N[Si](C)(C)C	3205.8	Semi standard non polar	33892256
Phenylalanylarginine,3TMS,isomer #14	C[Si](C)(C)N=C(NCCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C)C(=O)O)N[Si](C)(C)C	2743.8	Standard non polar	33892256
Phenylalanylarginine,3TMS,isomer #15	C[Si](C)(C)NC(=N)N(CCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C)C(=O)O)[Si](C)(C)C	3241.4	Semi standard non polar	33892256
Phenylalanylarginine,3TMS,isomer #15	C[Si](C)(C)NC(=N)N(CCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C)C(=O)O)[Si](C)(C)C	2947.7	Standard non polar	33892256
Phenylalanylarginine,3TMS,isomer #16	C[Si](C)(C)NC(=N)NCCC[C@@H](C(=O)O)N(C(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C)[Si](C)(C)C	3247.3	Semi standard non polar	33892256
Phenylalanylarginine,3TMS,isomer #16	C[Si](C)(C)NC(=N)NCCC[C@@H](C(=O)O)N(C(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C)[Si](C)(C)C	2872.7	Standard non polar	33892256
Phenylalanylarginine,3TMS,isomer #17	C[Si](C)(C)NC(=N)NCCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)C(=O)O	3399.6	Semi standard non polar	33892256
Phenylalanylarginine,3TMS,isomer #17	C[Si](C)(C)NC(=N)NCCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)C(=O)O	2948.7	Standard non polar	33892256
Phenylalanylarginine,3TMS,isomer #18	C[Si](C)(C)N(C(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)[C@@H](CCCNC(=N)N)C(=O)O	3206.9	Semi standard non polar	33892256
Phenylalanylarginine,3TMS,isomer #18	C[Si](C)(C)N(C(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)[C@@H](CCCNC(=N)N)C(=O)O	2872.7	Standard non polar	33892256
Phenylalanylarginine,3TMS,isomer #19	C[Si](C)(C)N(CCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)C(=O)O)C(=N)N	3278.3	Semi standard non polar	33892256
Phenylalanylarginine,3TMS,isomer #19	C[Si](C)(C)N(CCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)C(=O)O)C(=N)N	2961.2	Standard non polar	33892256
Phenylalanylarginine,3TMS,isomer #2	C[Si](C)(C)OC(=O)[C@H](CCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)[C@@H](N)CC1=CC=CC=C1	3214.1	Semi standard non polar	33892256
Phenylalanylarginine,3TMS,isomer #2	C[Si](C)(C)OC(=O)[C@H](CCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)[C@@H](N)CC1=CC=CC=C1	2932.7	Standard non polar	33892256
Phenylalanylarginine,3TMS,isomer #20	C[Si](C)(C)N=C(N)NCCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)C(=O)O	3174.6	Semi standard non polar	33892256
Phenylalanylarginine,3TMS,isomer #20	C[Si](C)(C)N=C(N)NCCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)C(=O)O	2877.5	Standard non polar	33892256
Phenylalanylarginine,3TMS,isomer #21	C[Si](C)(C)N[C@@H](CC1=CC=CC=C1)C(=O)N([C@@H](CCCN(C(=N)N)[Si](C)(C)C)C(=O)O)[Si](C)(C)C	3091.3	Semi standard non polar	33892256
Phenylalanylarginine,3TMS,isomer #21	C[Si](C)(C)N[C@@H](CC1=CC=CC=C1)C(=O)N([C@@H](CCCN(C(=N)N)[Si](C)(C)C)C(=O)O)[Si](C)(C)C	2874.9	Standard non polar	33892256
Phenylalanylarginine,3TMS,isomer #22	C[Si](C)(C)N=C(N)NCCC[C@@H](C(=O)O)N(C(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C)[Si](C)(C)C	3024.2	Semi standard non polar	33892256
Phenylalanylarginine,3TMS,isomer #22	C[Si](C)(C)N=C(N)NCCC[C@@H](C(=O)O)N(C(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C)[Si](C)(C)C	2793.1	Standard non polar	33892256
Phenylalanylarginine,3TMS,isomer #23	C[Si](C)(C)N=C(N)N(CCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C)C(=O)O)[Si](C)(C)C	3097.0	Semi standard non polar	33892256
Phenylalanylarginine,3TMS,isomer #23	C[Si](C)(C)N=C(N)N(CCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C)C(=O)O)[Si](C)(C)C	2747.6	Standard non polar	33892256
Phenylalanylarginine,3TMS,isomer #24	C[Si](C)(C)N=C(NCCC[C@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)C(=O)O)N([Si](C)(C)C)[Si](C)(C)C	3160.8	Semi standard non polar	33892256
Phenylalanylarginine,3TMS,isomer #24	C[Si](C)(C)N=C(NCCC[C@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)C(=O)O)N([Si](C)(C)C)[Si](C)(C)C	2732.4	Standard non polar	33892256
Phenylalanylarginine,3TMS,isomer #25	C[Si](C)(C)N(CCC[C@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)C(=O)O)C(=N)N([Si](C)(C)C)[Si](C)(C)C	3228.3	Semi standard non polar	33892256
Phenylalanylarginine,3TMS,isomer #25	C[Si](C)(C)N(CCC[C@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)C(=O)O)C(=N)N([Si](C)(C)C)[Si](C)(C)C	3070.0	Standard non polar	33892256
Phenylalanylarginine,3TMS,isomer #26	C[Si](C)(C)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[C@@H](CCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)C(=O)O	3171.7	Semi standard non polar	33892256
Phenylalanylarginine,3TMS,isomer #26	C[Si](C)(C)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[C@@H](CCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)C(=O)O	2977.2	Standard non polar	33892256
Phenylalanylarginine,3TMS,isomer #27	C[Si](C)(C)N=C(N[Si](C)(C)C)N(CCC[C@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	3151.5	Semi standard non polar	33892256
Phenylalanylarginine,3TMS,isomer #27	C[Si](C)(C)N=C(N[Si](C)(C)C)N(CCC[C@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	2648.3	Standard non polar	33892256
Phenylalanylarginine,3TMS,isomer #28	C[Si](C)(C)N=C(NCCC[C@@H](C(=O)O)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C)N[Si](C)(C)C	3131.5	Semi standard non polar	33892256
Phenylalanylarginine,3TMS,isomer #28	C[Si](C)(C)N=C(NCCC[C@@H](C(=O)O)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C)N[Si](C)(C)C	2694.6	Standard non polar	33892256
Phenylalanylarginine,3TMS,isomer #29	C[Si](C)(C)NC(=N)N(CCC[C@@H](C(=O)O)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C)[Si](C)(C)C	3133.6	Semi standard non polar	33892256
Phenylalanylarginine,3TMS,isomer #29	C[Si](C)(C)NC(=N)N(CCC[C@@H](C(=O)O)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C)[Si](C)(C)C	2909.1	Standard non polar	33892256
Phenylalanylarginine,3TMS,isomer #3	C[Si](C)(C)N=C(NCCC[C@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)N[Si](C)(C)C	3129.6	Semi standard non polar	33892256
Phenylalanylarginine,3TMS,isomer #3	C[Si](C)(C)N=C(NCCC[C@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)N[Si](C)(C)C	2598.4	Standard non polar	33892256
Phenylalanylarginine,3TMS,isomer #30	C[Si](C)(C)N=C(N)N(CCC[C@@H](C(=O)O)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C)[Si](C)(C)C	3026.6	Semi standard non polar	33892256
Phenylalanylarginine,3TMS,isomer #30	C[Si](C)(C)N=C(N)N(CCC[C@@H](C(=O)O)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C)[Si](C)(C)C	2695.2	Standard non polar	33892256
Phenylalanylarginine,3TMS,isomer #4	C[Si](C)(C)NC(=N)N(CCC[C@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C	3165.3	Semi standard non polar	33892256
Phenylalanylarginine,3TMS,isomer #4	C[Si](C)(C)NC(=N)N(CCC[C@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C	2860.5	Standard non polar	33892256
Phenylalanylarginine,3TMS,isomer #5	C[Si](C)(C)NC(=N)NCCC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C	3143.7	Semi standard non polar	33892256
Phenylalanylarginine,3TMS,isomer #5	C[Si](C)(C)NC(=N)NCCC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C	2790.7	Standard non polar	33892256
Phenylalanylarginine,3TMS,isomer #6	C[Si](C)(C)OC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C	3222.7	Semi standard non polar	33892256
Phenylalanylarginine,3TMS,isomer #6	C[Si](C)(C)OC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C	2858.5	Standard non polar	33892256
Phenylalanylarginine,3TMS,isomer #7	C[Si](C)(C)N[C@@H](CC1=CC=CC=C1)C(=O)N([C@@H](CCCNC(=N)N)C(=O)O[Si](C)(C)C)[Si](C)(C)C	3064.7	Semi standard non polar	33892256
Phenylalanylarginine,3TMS,isomer #7	C[Si](C)(C)N[C@@H](CC1=CC=CC=C1)C(=O)N([C@@H](CCCNC(=N)N)C(=O)O[Si](C)(C)C)[Si](C)(C)C	2754.3	Standard non polar	33892256
Phenylalanylarginine,3TMS,isomer #8	C[Si](C)(C)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CCCN(C(=N)N)[Si](C)(C)C)C(=O)O[Si](C)(C)C	3094.9	Semi standard non polar	33892256
Phenylalanylarginine,3TMS,isomer #8	C[Si](C)(C)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CCCN(C(=N)N)[Si](C)(C)C)C(=O)O[Si](C)(C)C	2839.3	Standard non polar	33892256
Phenylalanylarginine,3TMS,isomer #9	C[Si](C)(C)N=C(N)NCCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C)C(=O)O[Si](C)(C)C	3008.6	Semi standard non polar	33892256
Phenylalanylarginine,3TMS,isomer #9	C[Si](C)(C)N=C(N)NCCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C)C(=O)O[Si](C)(C)C	2732.7	Standard non polar	33892256
Phenylalanylarginine,4TMS,isomer #1	C[Si](C)(C)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	3195.6	Semi standard non polar	33892256
Phenylalanylarginine,4TMS,isomer #1	C[Si](C)(C)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	2989.9	Standard non polar	33892256
Phenylalanylarginine,4TMS,isomer #10	C[Si](C)(C)N=C(NCCC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C)N[Si](C)(C)C	3051.1	Semi standard non polar	33892256
Phenylalanylarginine,4TMS,isomer #10	C[Si](C)(C)N=C(NCCC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C)N[Si](C)(C)C	2654.4	Standard non polar	33892256
Phenylalanylarginine,4TMS,isomer #11	C[Si](C)(C)NC(=N)N(CCC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C)[Si](C)(C)C	3086.9	Semi standard non polar	33892256
Phenylalanylarginine,4TMS,isomer #11	C[Si](C)(C)NC(=N)N(CCC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C)[Si](C)(C)C	2884.9	Standard non polar	33892256
Phenylalanylarginine,4TMS,isomer #12	C[Si](C)(C)OC(=O)[C@H](CCCN(C(=N)N)[Si](C)(C)C)NC(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C	3203.1	Semi standard non polar	33892256
Phenylalanylarginine,4TMS,isomer #12	C[Si](C)(C)OC(=O)[C@H](CCCN(C(=N)N)[Si](C)(C)C)NC(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C	2949.4	Standard non polar	33892256
Phenylalanylarginine,4TMS,isomer #13	C[Si](C)(C)N=C(N)NCCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	3085.4	Semi standard non polar	33892256
Phenylalanylarginine,4TMS,isomer #13	C[Si](C)(C)N=C(N)NCCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	2840.6	Standard non polar	33892256
Phenylalanylarginine,4TMS,isomer #14	C[Si](C)(C)OC(=O)[C@H](CCCNC(=N)N)N(C(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3141.9	Semi standard non polar	33892256
Phenylalanylarginine,4TMS,isomer #14	C[Si](C)(C)OC(=O)[C@H](CCCNC(=N)N)N(C(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	2868.7	Standard non polar	33892256
Phenylalanylarginine,4TMS,isomer #15	C[Si](C)(C)N[C@@H](CC1=CC=CC=C1)C(=O)N([C@@H](CCCN(C(=N)N)[Si](C)(C)C)C(=O)O[Si](C)(C)C)[Si](C)(C)C	3056.5	Semi standard non polar	33892256
Phenylalanylarginine,4TMS,isomer #15	C[Si](C)(C)N[C@@H](CC1=CC=CC=C1)C(=O)N([C@@H](CCCN(C(=N)N)[Si](C)(C)C)C(=O)O[Si](C)(C)C)[Si](C)(C)C	2863.2	Standard non polar	33892256
Phenylalanylarginine,4TMS,isomer #16	C[Si](C)(C)N=C(N)NCCC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C)[Si](C)(C)C	2956.2	Semi standard non polar	33892256
Phenylalanylarginine,4TMS,isomer #16	C[Si](C)(C)N=C(N)NCCC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C)[Si](C)(C)C	2763.0	Standard non polar	33892256
Phenylalanylarginine,4TMS,isomer #17	C[Si](C)(C)N=C(N)N(CCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C)C(=O)O[Si](C)(C)C)[Si](C)(C)C	3023.3	Semi standard non polar	33892256
Phenylalanylarginine,4TMS,isomer #17	C[Si](C)(C)N=C(N)N(CCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C)C(=O)O[Si](C)(C)C)[Si](C)(C)C	2664.1	Standard non polar	33892256
Phenylalanylarginine,4TMS,isomer #18	C[Si](C)(C)N=C(N)N(CCC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C)[Si](C)(C)C	2961.2	Semi standard non polar	33892256
Phenylalanylarginine,4TMS,isomer #18	C[Si](C)(C)N=C(N)N(CCC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C)[Si](C)(C)C	2637.2	Standard non polar	33892256
Phenylalanylarginine,4TMS,isomer #19	C[Si](C)(C)N(C(=N)NCCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)C(=O)O)[Si](C)(C)C	3344.6	Semi standard non polar	33892256
Phenylalanylarginine,4TMS,isomer #19	C[Si](C)(C)N(C(=N)NCCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)C(=O)O)[Si](C)(C)C	3120.7	Standard non polar	33892256
Phenylalanylarginine,4TMS,isomer #2	C[Si](C)(C)N=C(NCCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C)C(=O)O[Si](C)(C)C)N[Si](C)(C)C	3121.3	Semi standard non polar	33892256
Phenylalanylarginine,4TMS,isomer #2	C[Si](C)(C)N=C(NCCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C)C(=O)O[Si](C)(C)C)N[Si](C)(C)C	2700.1	Standard non polar	33892256
Phenylalanylarginine,4TMS,isomer #20	C[Si](C)(C)N[C@@H](CC1=CC=CC=C1)C(=O)N([C@@H](CCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)C(=O)O)[Si](C)(C)C	3180.3	Semi standard non polar	33892256
Phenylalanylarginine,4TMS,isomer #20	C[Si](C)(C)N[C@@H](CC1=CC=CC=C1)C(=O)N([C@@H](CCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)C(=O)O)[Si](C)(C)C	3025.9	Standard non polar	33892256
Phenylalanylarginine,4TMS,isomer #21	C[Si](C)(C)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CCCN(C(=N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(=O)O	3194.9	Semi standard non polar	33892256
Phenylalanylarginine,4TMS,isomer #21	C[Si](C)(C)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CCCN(C(=N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(=O)O	3119.7	Standard non polar	33892256
Phenylalanylarginine,4TMS,isomer #22	C[Si](C)(C)N=C(NCCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C)C(=O)O)N([Si](C)(C)C)[Si](C)(C)C	3148.1	Semi standard non polar	33892256
Phenylalanylarginine,4TMS,isomer #22	C[Si](C)(C)N=C(NCCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C)C(=O)O)N([Si](C)(C)C)[Si](C)(C)C	2790.2	Standard non polar	33892256
Phenylalanylarginine,4TMS,isomer #23	C[Si](C)(C)N=C(N[Si](C)(C)C)N(CCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C)C(=O)O)[Si](C)(C)C	3154.3	Semi standard non polar	33892256
Phenylalanylarginine,4TMS,isomer #23	C[Si](C)(C)N=C(N[Si](C)(C)C)N(CCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C)C(=O)O)[Si](C)(C)C	2718.9	Standard non polar	33892256
Phenylalanylarginine,4TMS,isomer #24	C[Si](C)(C)N=C(NCCC[C@@H](C(=O)O)N(C(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	3130.4	Semi standard non polar	33892256
Phenylalanylarginine,4TMS,isomer #24	C[Si](C)(C)N=C(NCCC[C@@H](C(=O)O)N(C(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	2752.0	Standard non polar	33892256
Phenylalanylarginine,4TMS,isomer #25	C[Si](C)(C)N=C(NCCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)C(=O)O)N[Si](C)(C)C	3274.5	Semi standard non polar	33892256
Phenylalanylarginine,4TMS,isomer #25	C[Si](C)(C)N=C(NCCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)C(=O)O)N[Si](C)(C)C	2814.5	Standard non polar	33892256
Phenylalanylarginine,4TMS,isomer #26	C[Si](C)(C)NC(=N)N(CCC[C@@H](C(=O)O)N(C(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3171.3	Semi standard non polar	33892256
Phenylalanylarginine,4TMS,isomer #26	C[Si](C)(C)NC(=N)N(CCC[C@@H](C(=O)O)N(C(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	2968.9	Standard non polar	33892256
Phenylalanylarginine,4TMS,isomer #27	C[Si](C)(C)NC(=N)N(CCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)C(=O)O)[Si](C)(C)C	3317.4	Semi standard non polar	33892256
Phenylalanylarginine,4TMS,isomer #27	C[Si](C)(C)NC(=N)N(CCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)C(=O)O)[Si](C)(C)C	3058.7	Standard non polar	33892256
Phenylalanylarginine,4TMS,isomer #28	C[Si](C)(C)NC(=N)NCCC[C@@H](C(=O)O)N(C(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3303.5	Semi standard non polar	33892256
Phenylalanylarginine,4TMS,isomer #28	C[Si](C)(C)NC(=N)NCCC[C@@H](C(=O)O)N(C(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	2976.0	Standard non polar	33892256
Phenylalanylarginine,4TMS,isomer #29	C[Si](C)(C)N(CCC[C@@H](C(=O)O)N(C(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(=N)N	3184.8	Semi standard non polar	33892256
Phenylalanylarginine,4TMS,isomer #29	C[Si](C)(C)N(CCC[C@@H](C(=O)O)N(C(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(=N)N	2991.1	Standard non polar	33892256
Phenylalanylarginine,4TMS,isomer #3	C[Si](C)(C)NC(=N)N(CCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C)C(=O)O[Si](C)(C)C)[Si](C)(C)C	3173.2	Semi standard non polar	33892256
Phenylalanylarginine,4TMS,isomer #3	C[Si](C)(C)NC(=N)N(CCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C)C(=O)O[Si](C)(C)C)[Si](C)(C)C	2925.4	Standard non polar	33892256
Phenylalanylarginine,4TMS,isomer #30	C[Si](C)(C)N=C(N)NCCC[C@@H](C(=O)O)N(C(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3110.0	Semi standard non polar	33892256
Phenylalanylarginine,4TMS,isomer #30	C[Si](C)(C)N=C(N)NCCC[C@@H](C(=O)O)N(C(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	2891.7	Standard non polar	33892256
Phenylalanylarginine,4TMS,isomer #31	C[Si](C)(C)N=C(N)N(CCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)C(=O)O)[Si](C)(C)C	3194.3	Semi standard non polar	33892256
Phenylalanylarginine,4TMS,isomer #31	C[Si](C)(C)N=C(N)N(CCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)C(=O)O)[Si](C)(C)C	2829.6	Standard non polar	33892256
Phenylalanylarginine,4TMS,isomer #32	C[Si](C)(C)N=C(N)N(CCC[C@@H](C(=O)O)N(C(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3044.9	Semi standard non polar	33892256
Phenylalanylarginine,4TMS,isomer #32	C[Si](C)(C)N=C(N)N(CCC[C@@H](C(=O)O)N(C(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	2755.0	Standard non polar	33892256
Phenylalanylarginine,4TMS,isomer #33	C[Si](C)(C)N=C(N(CCC[C@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3124.0	Semi standard non polar	33892256
Phenylalanylarginine,4TMS,isomer #33	C[Si](C)(C)N=C(N(CCC[C@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2786.0	Standard non polar	33892256
Phenylalanylarginine,4TMS,isomer #34	C[Si](C)(C)N=C(NCCC[C@@H](C(=O)O)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3086.9	Semi standard non polar	33892256
Phenylalanylarginine,4TMS,isomer #34	C[Si](C)(C)N=C(NCCC[C@@H](C(=O)O)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2734.4	Standard non polar	33892256
Phenylalanylarginine,4TMS,isomer #35	C[Si](C)(C)N(CCC[C@@H](C(=O)O)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C)C(=N)N([Si](C)(C)C)[Si](C)(C)C	3119.4	Semi standard non polar	33892256
Phenylalanylarginine,4TMS,isomer #35	C[Si](C)(C)N(CCC[C@@H](C(=O)O)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C)C(=N)N([Si](C)(C)C)[Si](C)(C)C	3085.8	Standard non polar	33892256
Phenylalanylarginine,4TMS,isomer #36	C[Si](C)(C)N=C(N[Si](C)(C)C)N(CCC[C@@H](C(=O)O)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C)[Si](C)(C)C	3081.6	Semi standard non polar	33892256
Phenylalanylarginine,4TMS,isomer #36	C[Si](C)(C)N=C(N[Si](C)(C)C)N(CCC[C@@H](C(=O)O)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C)[Si](C)(C)C	2669.2	Standard non polar	33892256
Phenylalanylarginine,4TMS,isomer #4	C[Si](C)(C)NC(=N)NCCC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C)[Si](C)(C)C	3160.7	Semi standard non polar	33892256
Phenylalanylarginine,4TMS,isomer #4	C[Si](C)(C)NC(=N)NCCC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C)[Si](C)(C)C	2859.2	Standard non polar	33892256
Phenylalanylarginine,4TMS,isomer #5	C[Si](C)(C)NC(=N)NCCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	3299.2	Semi standard non polar	33892256
Phenylalanylarginine,4TMS,isomer #5	C[Si](C)(C)NC(=N)NCCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	2950.3	Standard non polar	33892256
Phenylalanylarginine,4TMS,isomer #6	C[Si](C)(C)OC(=O)[C@H](CCCN(C(=N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)NC(=O)[C@@H](N)CC1=CC=CC=C1	3159.5	Semi standard non polar	33892256
Phenylalanylarginine,4TMS,isomer #6	C[Si](C)(C)OC(=O)[C@H](CCCN(C(=N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)NC(=O)[C@@H](N)CC1=CC=CC=C1	3021.6	Standard non polar	33892256
Phenylalanylarginine,4TMS,isomer #7	C[Si](C)(C)N=C(NCCC[C@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3070.9	Semi standard non polar	33892256
Phenylalanylarginine,4TMS,isomer #7	C[Si](C)(C)N=C(NCCC[C@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2638.1	Standard non polar	33892256
Phenylalanylarginine,4TMS,isomer #8	C[Si](C)(C)OC(=O)[C@H](CCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C	3100.2	Semi standard non polar	33892256
Phenylalanylarginine,4TMS,isomer #8	C[Si](C)(C)OC(=O)[C@H](CCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C	2941.3	Standard non polar	33892256
Phenylalanylarginine,4TMS,isomer #9	C[Si](C)(C)N=C(N[Si](C)(C)C)N(CCC[C@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C	3060.3	Semi standard non polar	33892256
Phenylalanylarginine,4TMS,isomer #9	C[Si](C)(C)N=C(N[Si](C)(C)C)N(CCC[C@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C	2568.1	Standard non polar	33892256
Phenylalanylarginine,5TMS,isomer #1	C[Si](C)(C)OC(=O)[C@H](CCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C	3319.3	Semi standard non polar	33892256
Phenylalanylarginine,5TMS,isomer #1	C[Si](C)(C)OC(=O)[C@H](CCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C	3093.3	Standard non polar	33892256
Phenylalanylarginine,5TMS,isomer #10	C[Si](C)(C)NC(=N)NCCC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3262.3	Semi standard non polar	33892256
Phenylalanylarginine,5TMS,isomer #10	C[Si](C)(C)NC(=N)NCCC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	2961.6	Standard non polar	33892256
Phenylalanylarginine,5TMS,isomer #11	C[Si](C)(C)N=C(N(CCC[C@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3055.6	Semi standard non polar	33892256
Phenylalanylarginine,5TMS,isomer #11	C[Si](C)(C)N=C(N(CCC[C@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2725.0	Standard non polar	33892256
Phenylalanylarginine,5TMS,isomer #12	C[Si](C)(C)OC(=O)[C@H](CCCN(C(=N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C	3120.9	Semi standard non polar	33892256
Phenylalanylarginine,5TMS,isomer #12	C[Si](C)(C)OC(=O)[C@H](CCCN(C(=N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C	3034.7	Standard non polar	33892256
Phenylalanylarginine,5TMS,isomer #13	C[Si](C)(C)N=C(NCCC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3023.4	Semi standard non polar	33892256
Phenylalanylarginine,5TMS,isomer #13	C[Si](C)(C)N=C(NCCC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2687.6	Standard non polar	33892256
Phenylalanylarginine,5TMS,isomer #14	C[Si](C)(C)N=C(N[Si](C)(C)C)N(CCC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C)[Si](C)(C)C	3017.0	Semi standard non polar	33892256
Phenylalanylarginine,5TMS,isomer #14	C[Si](C)(C)N=C(N[Si](C)(C)C)N(CCC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C)[Si](C)(C)C	2637.5	Standard non polar	33892256
Phenylalanylarginine,5TMS,isomer #15	C[Si](C)(C)N=C(N)N(CCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C)[Si](C)(C)C	3173.4	Semi standard non polar	33892256
Phenylalanylarginine,5TMS,isomer #15	C[Si](C)(C)N=C(N)N(CCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C)[Si](C)(C)C	2782.3	Standard non polar	33892256
Phenylalanylarginine,5TMS,isomer #16	C[Si](C)(C)OC(=O)[C@H](CCCN(C(=N)N)[Si](C)(C)C)N(C(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3201.5	Semi standard non polar	33892256
Phenylalanylarginine,5TMS,isomer #16	C[Si](C)(C)OC(=O)[C@H](CCCN(C(=N)N)[Si](C)(C)C)N(C(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	2977.5	Standard non polar	33892256
Phenylalanylarginine,5TMS,isomer #17	C[Si](C)(C)N=C(N)NCCC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3087.5	Semi standard non polar	33892256
Phenylalanylarginine,5TMS,isomer #17	C[Si](C)(C)N=C(N)NCCC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	2868.2	Standard non polar	33892256
Phenylalanylarginine,5TMS,isomer #18	C[Si](C)(C)N=C(N)N(CCC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	2994.3	Semi standard non polar	33892256
Phenylalanylarginine,5TMS,isomer #18	C[Si](C)(C)N=C(N)N(CCC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	2723.7	Standard non polar	33892256
Phenylalanylarginine,5TMS,isomer #19	C[Si](C)(C)N=C(NCCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)C(=O)O)N([Si](C)(C)C)[Si](C)(C)C	3275.7	Semi standard non polar	33892256
Phenylalanylarginine,5TMS,isomer #19	C[Si](C)(C)N=C(NCCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)C(=O)O)N([Si](C)(C)C)[Si](C)(C)C	2872.9	Standard non polar	33892256
Phenylalanylarginine,5TMS,isomer #2	C[Si](C)(C)N[C@@H](CC1=CC=CC=C1)C(=O)N([C@@H](CCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C)[Si](C)(C)C	3133.2	Semi standard non polar	33892256
Phenylalanylarginine,5TMS,isomer #2	C[Si](C)(C)N[C@@H](CC1=CC=CC=C1)C(=O)N([C@@H](CCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C)[Si](C)(C)C	3004.0	Standard non polar	33892256
Phenylalanylarginine,5TMS,isomer #20	C[Si](C)(C)N(CCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)C(=O)O)C(=N)N([Si](C)(C)C)[Si](C)(C)C	3331.2	Semi standard non polar	33892256
Phenylalanylarginine,5TMS,isomer #20	C[Si](C)(C)N(CCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)C(=O)O)C(=N)N([Si](C)(C)C)[Si](C)(C)C	3223.9	Standard non polar	33892256
Phenylalanylarginine,5TMS,isomer #21	C[Si](C)(C)N(C(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)[C@@H](CCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)C(=O)O	3290.8	Semi standard non polar	33892256
Phenylalanylarginine,5TMS,isomer #21	C[Si](C)(C)N(C(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)[C@@H](CCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)C(=O)O	3125.3	Standard non polar	33892256
Phenylalanylarginine,5TMS,isomer #22	C[Si](C)(C)N[C@@H](CC1=CC=CC=C1)C(=O)N([C@@H](CCCN(C(=N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(=O)O)[Si](C)(C)C	3181.8	Semi standard non polar	33892256
Phenylalanylarginine,5TMS,isomer #22	C[Si](C)(C)N[C@@H](CC1=CC=CC=C1)C(=O)N([C@@H](CCCN(C(=N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(=O)O)[Si](C)(C)C	3122.4	Standard non polar	33892256
Phenylalanylarginine,5TMS,isomer #23	C[Si](C)(C)N=C(NCCC[C@@H](C(=O)O)N(C(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3116.8	Semi standard non polar	33892256
Phenylalanylarginine,5TMS,isomer #23	C[Si](C)(C)N=C(NCCC[C@@H](C(=O)O)N(C(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2802.2	Standard non polar	33892256
Phenylalanylarginine,5TMS,isomer #24	C[Si](C)(C)N=C(N(CCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C)C(=O)O)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3161.0	Semi standard non polar	33892256
Phenylalanylarginine,5TMS,isomer #24	C[Si](C)(C)N=C(N(CCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C)C(=O)O)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2858.0	Standard non polar	33892256
Phenylalanylarginine,5TMS,isomer #25	C[Si](C)(C)N=C(N[Si](C)(C)C)N(CCC[C@@H](C(=O)O)N(C(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3111.2	Semi standard non polar	33892256
Phenylalanylarginine,5TMS,isomer #25	C[Si](C)(C)N=C(N[Si](C)(C)C)N(CCC[C@@H](C(=O)O)N(C(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	2757.0	Standard non polar	33892256
Phenylalanylarginine,5TMS,isomer #26	C[Si](C)(C)N=C(N[Si](C)(C)C)N(CCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)C(=O)O)[Si](C)(C)C	3255.4	Semi standard non polar	33892256
Phenylalanylarginine,5TMS,isomer #26	C[Si](C)(C)N=C(N[Si](C)(C)C)N(CCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)C(=O)O)[Si](C)(C)C	2810.1	Standard non polar	33892256
Phenylalanylarginine,5TMS,isomer #27	C[Si](C)(C)N=C(NCCC[C@@H](C(=O)O)N(C(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	3218.4	Semi standard non polar	33892256
Phenylalanylarginine,5TMS,isomer #27	C[Si](C)(C)N=C(NCCC[C@@H](C(=O)O)N(C(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	2850.1	Standard non polar	33892256
Phenylalanylarginine,5TMS,isomer #28	C[Si](C)(C)NC(=N)N(CCC[C@@H](C(=O)O)N(C(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3267.4	Semi standard non polar	33892256
Phenylalanylarginine,5TMS,isomer #28	C[Si](C)(C)NC(=N)N(CCC[C@@H](C(=O)O)N(C(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3073.9	Standard non polar	33892256
Phenylalanylarginine,5TMS,isomer #29	C[Si](C)(C)N=C(N)N(CCC[C@@H](C(=O)O)N(C(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3179.9	Semi standard non polar	33892256
Phenylalanylarginine,5TMS,isomer #29	C[Si](C)(C)N=C(N)N(CCC[C@@H](C(=O)O)N(C(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	2865.5	Standard non polar	33892256
Phenylalanylarginine,5TMS,isomer #3	C[Si](C)(C)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CCCN(C(=N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	3177.7	Semi standard non polar	33892256
Phenylalanylarginine,5TMS,isomer #3	C[Si](C)(C)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CCCN(C(=N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	3069.6	Standard non polar	33892256
Phenylalanylarginine,5TMS,isomer #30	C[Si](C)(C)N=C(N(CCC[C@@H](C(=O)O)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3069.5	Semi standard non polar	33892256
Phenylalanylarginine,5TMS,isomer #30	C[Si](C)(C)N=C(N(CCC[C@@H](C(=O)O)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2804.9	Standard non polar	33892256
Phenylalanylarginine,5TMS,isomer #4	C[Si](C)(C)N=C(NCCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C)C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3092.2	Semi standard non polar	33892256
Phenylalanylarginine,5TMS,isomer #4	C[Si](C)(C)N=C(NCCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C)C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2728.5	Standard non polar	33892256
Phenylalanylarginine,5TMS,isomer #5	C[Si](C)(C)N=C(N[Si](C)(C)C)N(CCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C)C(=O)O[Si](C)(C)C)[Si](C)(C)C	3080.3	Semi standard non polar	33892256
Phenylalanylarginine,5TMS,isomer #5	C[Si](C)(C)N=C(N[Si](C)(C)C)N(CCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C)C(=O)O[Si](C)(C)C)[Si](C)(C)C	2673.9	Standard non polar	33892256
Phenylalanylarginine,5TMS,isomer #6	C[Si](C)(C)N=C(NCCC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	3075.5	Semi standard non polar	33892256
Phenylalanylarginine,5TMS,isomer #6	C[Si](C)(C)N=C(NCCC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	2744.9	Standard non polar	33892256
Phenylalanylarginine,5TMS,isomer #7	C[Si](C)(C)N=C(NCCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C)N[Si](C)(C)C	3198.4	Semi standard non polar	33892256
Phenylalanylarginine,5TMS,isomer #7	C[Si](C)(C)N=C(NCCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C)N[Si](C)(C)C	2810.2	Standard non polar	33892256
Phenylalanylarginine,5TMS,isomer #8	C[Si](C)(C)NC(=N)N(CCC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3129.3	Semi standard non polar	33892256
Phenylalanylarginine,5TMS,isomer #8	C[Si](C)(C)NC(=N)N(CCC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	2965.3	Standard non polar	33892256
Phenylalanylarginine,5TMS,isomer #9	C[Si](C)(C)NC(=N)N(CCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C)[Si](C)(C)C	3291.0	Semi standard non polar	33892256
Phenylalanylarginine,5TMS,isomer #9	C[Si](C)(C)NC(=N)N(CCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C)[Si](C)(C)C	3035.4	Standard non polar	33892256
Phenylalanylarginine,6TMS,isomer #1	C[Si](C)(C)OC(=O)[C@H](CCCN(C(=N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)NC(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C	3338.7	Semi standard non polar	33892256
Phenylalanylarginine,6TMS,isomer #1	C[Si](C)(C)OC(=O)[C@H](CCCN(C(=N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)NC(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C	3174.6	Standard non polar	33892256
Phenylalanylarginine,6TMS,isomer #10	C[Si](C)(C)NC(=N)N(CCC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3286.8	Semi standard non polar	33892256
Phenylalanylarginine,6TMS,isomer #10	C[Si](C)(C)NC(=N)N(CCC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3075.0	Standard non polar	33892256
Phenylalanylarginine,6TMS,isomer #11	C[Si](C)(C)N=C(N(CCC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3068.7	Semi standard non polar	33892256
Phenylalanylarginine,6TMS,isomer #11	C[Si](C)(C)N=C(N(CCC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2785.5	Standard non polar	33892256
Phenylalanylarginine,6TMS,isomer #12	C[Si](C)(C)N=C(N)N(CCC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3203.5	Semi standard non polar	33892256
Phenylalanylarginine,6TMS,isomer #12	C[Si](C)(C)N=C(N)N(CCC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	2840.3	Standard non polar	33892256
Phenylalanylarginine,6TMS,isomer #13	C[Si](C)(C)N=C(N(CCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)C(=O)O)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3306.8	Semi standard non polar	33892256
Phenylalanylarginine,6TMS,isomer #13	C[Si](C)(C)N=C(N(CCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)C(=O)O)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2954.7	Standard non polar	33892256
Phenylalanylarginine,6TMS,isomer #14	C[Si](C)(C)N=C(NCCC[C@@H](C(=O)O)N(C(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3276.2	Semi standard non polar	33892256
Phenylalanylarginine,6TMS,isomer #14	C[Si](C)(C)N=C(NCCC[C@@H](C(=O)O)N(C(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2908.3	Standard non polar	33892256
Phenylalanylarginine,6TMS,isomer #15	C[Si](C)(C)N(CCC[C@@H](C(=O)O)N(C(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(=N)N([Si](C)(C)C)[Si](C)(C)C	3336.7	Semi standard non polar	33892256
Phenylalanylarginine,6TMS,isomer #15	C[Si](C)(C)N(CCC[C@@H](C(=O)O)N(C(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(=N)N([Si](C)(C)C)[Si](C)(C)C	3221.4	Standard non polar	33892256
Phenylalanylarginine,6TMS,isomer #16	C[Si](C)(C)N=C(N(CCC[C@@H](C(=O)O)N(C(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3155.9	Semi standard non polar	33892256
Phenylalanylarginine,6TMS,isomer #16	C[Si](C)(C)N=C(N(CCC[C@@H](C(=O)O)N(C(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2906.0	Standard non polar	33892256
Phenylalanylarginine,6TMS,isomer #17	C[Si](C)(C)N=C(N[Si](C)(C)C)N(CCC[C@@H](C(=O)O)N(C(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3249.3	Semi standard non polar	33892256
Phenylalanylarginine,6TMS,isomer #17	C[Si](C)(C)N=C(N[Si](C)(C)C)N(CCC[C@@H](C(=O)O)N(C(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	2866.9	Standard non polar	33892256
Phenylalanylarginine,6TMS,isomer #2	C[Si](C)(C)N=C(NCCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3239.1	Semi standard non polar	33892256
Phenylalanylarginine,6TMS,isomer #2	C[Si](C)(C)N=C(NCCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2844.5	Standard non polar	33892256
Phenylalanylarginine,6TMS,isomer #3	C[Si](C)(C)OC(=O)[C@H](CCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)N(C(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3292.7	Semi standard non polar	33892256
Phenylalanylarginine,6TMS,isomer #3	C[Si](C)(C)OC(=O)[C@H](CCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)N(C(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3107.6	Standard non polar	33892256
Phenylalanylarginine,6TMS,isomer #4	C[Si](C)(C)N[C@@H](CC1=CC=CC=C1)C(=O)N([C@@H](CCCN(C(=N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C)[Si](C)(C)C	3169.9	Semi standard non polar	33892256
Phenylalanylarginine,6TMS,isomer #4	C[Si](C)(C)N[C@@H](CC1=CC=CC=C1)C(=O)N([C@@H](CCCN(C(=N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C)[Si](C)(C)C	3098.5	Standard non polar	33892256
Phenylalanylarginine,6TMS,isomer #5	C[Si](C)(C)N=C(NCCC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3077.2	Semi standard non polar	33892256
Phenylalanylarginine,6TMS,isomer #5	C[Si](C)(C)N=C(NCCC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2782.5	Standard non polar	33892256
Phenylalanylarginine,6TMS,isomer #6	C[Si](C)(C)N=C(N(CCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C)C(=O)O[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3120.2	Semi standard non polar	33892256
Phenylalanylarginine,6TMS,isomer #6	C[Si](C)(C)N=C(N(CCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C)C(=O)O[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2823.4	Standard non polar	33892256
Phenylalanylarginine,6TMS,isomer #7	C[Si](C)(C)N=C(N[Si](C)(C)C)N(CCC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3066.8	Semi standard non polar	33892256
Phenylalanylarginine,6TMS,isomer #7	C[Si](C)(C)N=C(N[Si](C)(C)C)N(CCC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	2745.0	Standard non polar	33892256
Phenylalanylarginine,6TMS,isomer #8	C[Si](C)(C)N=C(N[Si](C)(C)C)N(CCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C)[Si](C)(C)C	3215.5	Semi standard non polar	33892256
Phenylalanylarginine,6TMS,isomer #8	C[Si](C)(C)N=C(N[Si](C)(C)C)N(CCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C)[Si](C)(C)C	2795.4	Standard non polar	33892256
Phenylalanylarginine,6TMS,isomer #9	C[Si](C)(C)N=C(NCCC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	3192.4	Semi standard non polar	33892256
Phenylalanylarginine,6TMS,isomer #9	C[Si](C)(C)N=C(NCCC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	2854.7	Standard non polar	33892256
Phenylalanylarginine,7TMS,isomer #1	C[Si](C)(C)N=C(N(CCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N([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	3299.7	Semi standard non polar	33892256
Phenylalanylarginine,7TMS,isomer #1	C[Si](C)(C)N=C(N(CCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N([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	2954.2	Standard non polar	33892256
Phenylalanylarginine,7TMS,isomer #2	C[Si](C)(C)OC(=O)[C@H](CCCN(C(=N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N(C(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3362.7	Semi standard non polar	33892256
Phenylalanylarginine,7TMS,isomer #2	C[Si](C)(C)OC(=O)[C@H](CCCN(C(=N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N(C(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3208.3	Standard non polar	33892256
Phenylalanylarginine,7TMS,isomer #3	C[Si](C)(C)N=C(NCCC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3275.7	Semi standard non polar	33892256
Phenylalanylarginine,7TMS,isomer #3	C[Si](C)(C)N=C(NCCC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2904.5	Standard non polar	33892256
Phenylalanylarginine,7TMS,isomer #4	C[Si](C)(C)N=C(N(CCC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3129.9	Semi standard non polar	33892256
Phenylalanylarginine,7TMS,isomer #4	C[Si](C)(C)N=C(N(CCC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2906.3	Standard non polar	33892256
Phenylalanylarginine,7TMS,isomer #5	C[Si](C)(C)N=C(N[Si](C)(C)C)N(CCC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3268.7	Semi standard non polar	33892256
Phenylalanylarginine,7TMS,isomer #5	C[Si](C)(C)N=C(N[Si](C)(C)C)N(CCC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	2870.7	Standard non polar	33892256
Phenylalanylarginine,7TMS,isomer #6	C[Si](C)(C)N=C(N(CCC[C@@H](C(=O)O)N(C(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3327.6	Semi standard non polar	33892256
Phenylalanylarginine,7TMS,isomer #6	C[Si](C)(C)N=C(N(CCC[C@@H](C(=O)O)N(C(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3025.1	Standard non polar	33892256
Phenylalanylarginine,8TMS,isomer #1	C[Si](C)(C)N=C(N(CCC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3350.3	Semi standard non polar	33892256
Phenylalanylarginine,8TMS,isomer #1	C[Si](C)(C)N=C(N(CCC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3037.5	Standard non polar	33892256
Phenylalanylarginine,1TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CC1=CC=CC=C1	3389.6	Semi standard non polar	33892256
Phenylalanylarginine,1TBDMS,isomer #2	CC(C)(C)[Si](C)(C)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O	3404.9	Semi standard non polar	33892256
Phenylalanylarginine,1TBDMS,isomer #3	CC(C)(C)[Si](C)(C)NC(=N)NCCC[C@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)C(=O)O	3535.3	Semi standard non polar	33892256
Phenylalanylarginine,1TBDMS,isomer #4	CC(C)(C)[Si](C)(C)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[C@@H](CCCNC(=N)N)C(=O)O	3347.3	Semi standard non polar	33892256
Phenylalanylarginine,1TBDMS,isomer #5	CC(C)(C)[Si](C)(C)N(CCC[C@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)C(=O)O)C(=N)N	3446.1	Semi standard non polar	33892256
Phenylalanylarginine,1TBDMS,isomer #6	CC(C)(C)[Si](C)(C)N=C(N)NCCC[C@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)C(=O)O	3373.7	Semi standard non polar	33892256
Phenylalanylarginine,2TBDMS,isomer #1	CC(C)(C)[Si](C)(C)NC(=N)NCCC[C@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)C(=O)O[Si](C)(C)C(C)(C)C	3692.5	Semi standard non polar	33892256
Phenylalanylarginine,2TBDMS,isomer #1	CC(C)(C)[Si](C)(C)NC(=N)NCCC[C@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)C(=O)O[Si](C)(C)C(C)(C)C	3138.1	Standard non polar	33892256
Phenylalanylarginine,2TBDMS,isomer #10	CC(C)(C)[Si](C)(C)N=C(N)NCCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C(C)(C)C)C(=O)O	3505.1	Semi standard non polar	33892256
Phenylalanylarginine,2TBDMS,isomer #10	CC(C)(C)[Si](C)(C)N=C(N)NCCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C(C)(C)C)C(=O)O	3117.9	Standard non polar	33892256
Phenylalanylarginine,2TBDMS,isomer #11	CC(C)(C)[Si](C)(C)N(C(=N)NCCC[C@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C(C)(C)C	3702.1	Semi standard non polar	33892256
Phenylalanylarginine,2TBDMS,isomer #11	CC(C)(C)[Si](C)(C)N(C(=N)NCCC[C@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C(C)(C)C	3265.7	Standard non polar	33892256
Phenylalanylarginine,2TBDMS,isomer #12	CC(C)(C)[Si](C)(C)N=C(NCCC[C@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)C(=O)O)N[Si](C)(C)C(C)(C)C	3655.9	Semi standard non polar	33892256
Phenylalanylarginine,2TBDMS,isomer #12	CC(C)(C)[Si](C)(C)N=C(NCCC[C@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)C(=O)O)N[Si](C)(C)C(C)(C)C	3003.1	Standard non polar	33892256
Phenylalanylarginine,2TBDMS,isomer #13	CC(C)(C)[Si](C)(C)NC(=N)N(CCC[C@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C(C)(C)C	3710.1	Semi standard non polar	33892256
Phenylalanylarginine,2TBDMS,isomer #13	CC(C)(C)[Si](C)(C)NC(=N)N(CCC[C@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C(C)(C)C	3242.5	Standard non polar	33892256
Phenylalanylarginine,2TBDMS,isomer #14	CC(C)(C)[Si](C)(C)NC(=N)NCCC[C@@H](C(=O)O)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C(C)(C)C	3618.9	Semi standard non polar	33892256
Phenylalanylarginine,2TBDMS,isomer #14	CC(C)(C)[Si](C)(C)NC(=N)NCCC[C@@H](C(=O)O)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C(C)(C)C	3158.8	Standard non polar	33892256
Phenylalanylarginine,2TBDMS,isomer #15	CC(C)(C)[Si](C)(C)N(CCC[C@@H](C(=O)O)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C(C)(C)C)C(=N)N	3543.3	Semi standard non polar	33892256
Phenylalanylarginine,2TBDMS,isomer #15	CC(C)(C)[Si](C)(C)N(CCC[C@@H](C(=O)O)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C(C)(C)C)C(=N)N	3186.1	Standard non polar	33892256
Phenylalanylarginine,2TBDMS,isomer #16	CC(C)(C)[Si](C)(C)N=C(N)NCCC[C@@H](C(=O)O)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C(C)(C)C	3470.0	Semi standard non polar	33892256
Phenylalanylarginine,2TBDMS,isomer #16	CC(C)(C)[Si](C)(C)N=C(N)NCCC[C@@H](C(=O)O)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C(C)(C)C	3079.4	Standard non polar	33892256
Phenylalanylarginine,2TBDMS,isomer #17	CC(C)(C)[Si](C)(C)N=C(N)N(CCC[C@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C(C)(C)C	3586.9	Semi standard non polar	33892256
Phenylalanylarginine,2TBDMS,isomer #17	CC(C)(C)[Si](C)(C)N=C(N)N(CCC[C@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C(C)(C)C	3035.6	Standard non polar	33892256
Phenylalanylarginine,2TBDMS,isomer #2	CC(C)(C)[Si](C)(C)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O[Si](C)(C)C(C)(C)C	3539.1	Semi standard non polar	33892256
Phenylalanylarginine,2TBDMS,isomer #2	CC(C)(C)[Si](C)(C)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O[Si](C)(C)C(C)(C)C	3142.7	Standard non polar	33892256
Phenylalanylarginine,2TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCCN(C(=N)N)[Si](C)(C)C(C)(C)C)NC(=O)[C@@H](N)CC1=CC=CC=C1	3589.1	Semi standard non polar	33892256
Phenylalanylarginine,2TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCCN(C(=N)N)[Si](C)(C)C(C)(C)C)NC(=O)[C@@H](N)CC1=CC=CC=C1	3153.5	Standard non polar	33892256
Phenylalanylarginine,2TBDMS,isomer #4	CC(C)(C)[Si](C)(C)N=C(N)NCCC[C@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)C(=O)O[Si](C)(C)C(C)(C)C	3474.7	Semi standard non polar	33892256
Phenylalanylarginine,2TBDMS,isomer #4	CC(C)(C)[Si](C)(C)N=C(N)NCCC[C@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)C(=O)O[Si](C)(C)C(C)(C)C	3029.0	Standard non polar	33892256
Phenylalanylarginine,2TBDMS,isomer #5	CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCCNC(=N)N)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C(C)(C)C	3484.9	Semi standard non polar	33892256
Phenylalanylarginine,2TBDMS,isomer #5	CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCCNC(=N)N)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C(C)(C)C	3091.4	Standard non polar	33892256
Phenylalanylarginine,2TBDMS,isomer #6	CC(C)(C)[Si](C)(C)NC(=N)NCCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C(C)(C)C)C(=O)O	3705.0	Semi standard non polar	33892256
Phenylalanylarginine,2TBDMS,isomer #6	CC(C)(C)[Si](C)(C)NC(=N)NCCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C(C)(C)C)C(=O)O	3199.0	Standard non polar	33892256
Phenylalanylarginine,2TBDMS,isomer #7	CC(C)(C)[Si](C)(C)N([C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[Si](C)(C)C(C)(C)C	3693.9	Semi standard non polar	33892256
Phenylalanylarginine,2TBDMS,isomer #7	CC(C)(C)[Si](C)(C)N([C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[Si](C)(C)C(C)(C)C	3194.0	Standard non polar	33892256
Phenylalanylarginine,2TBDMS,isomer #8	CC(C)(C)[Si](C)(C)N[C@@H](CC1=CC=CC=C1)C(=O)N([C@@H](CCCNC(=N)N)C(=O)O)[Si](C)(C)C(C)(C)C	3512.5	Semi standard non polar	33892256
Phenylalanylarginine,2TBDMS,isomer #8	CC(C)(C)[Si](C)(C)N[C@@H](CC1=CC=CC=C1)C(=O)N([C@@H](CCCNC(=N)N)C(=O)O)[Si](C)(C)C(C)(C)C	3137.6	Standard non polar	33892256
Phenylalanylarginine,2TBDMS,isomer #9	CC(C)(C)[Si](C)(C)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CCCN(C(=N)N)[Si](C)(C)C(C)(C)C)C(=O)O	3618.3	Semi standard non polar	33892256
Phenylalanylarginine,2TBDMS,isomer #9	CC(C)(C)[Si](C)(C)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CCCN(C(=N)N)[Si](C)(C)C(C)(C)C)C(=O)O	3239.8	Standard non polar	33892256
Phenylalanylarginine,3TBDMS,isomer #1	CC(C)(C)[Si](C)(C)NC(=N)NCCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C	3840.4	Semi standard non polar	33892256
Phenylalanylarginine,3TBDMS,isomer #1	CC(C)(C)[Si](C)(C)NC(=N)NCCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C	3356.8	Standard non polar	33892256
Phenylalanylarginine,3TBDMS,isomer #10	CC(C)(C)[Si](C)(C)N=C(N)N(CCC[C@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3716.4	Semi standard non polar	33892256
Phenylalanylarginine,3TBDMS,isomer #10	CC(C)(C)[Si](C)(C)N=C(N)N(CCC[C@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3098.9	Standard non polar	33892256
Phenylalanylarginine,3TBDMS,isomer #11	CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCCN(C(=N)N)[Si](C)(C)C(C)(C)C)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C(C)(C)C	3710.4	Semi standard non polar	33892256
Phenylalanylarginine,3TBDMS,isomer #11	CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCCN(C(=N)N)[Si](C)(C)C(C)(C)C)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C(C)(C)C	3315.5	Standard non polar	33892256
Phenylalanylarginine,3TBDMS,isomer #12	CC(C)(C)[Si](C)(C)N=C(N)NCCC[C@@H](C(=O)O[Si](C)(C)C(C)(C)C)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C(C)(C)C	3593.2	Semi standard non polar	33892256
Phenylalanylarginine,3TBDMS,isomer #12	CC(C)(C)[Si](C)(C)N=C(N)NCCC[C@@H](C(=O)O[Si](C)(C)C(C)(C)C)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C(C)(C)C	3199.1	Standard non polar	33892256
Phenylalanylarginine,3TBDMS,isomer #13	CC(C)(C)[Si](C)(C)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CCCNC(=N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O	3849.1	Semi standard non polar	33892256
Phenylalanylarginine,3TBDMS,isomer #13	CC(C)(C)[Si](C)(C)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CCCNC(=N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O	3489.4	Standard non polar	33892256
Phenylalanylarginine,3TBDMS,isomer #14	CC(C)(C)[Si](C)(C)N=C(NCCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C(C)(C)C)C(=O)O)N[Si](C)(C)C(C)(C)C	3802.8	Semi standard non polar	33892256
Phenylalanylarginine,3TBDMS,isomer #14	CC(C)(C)[Si](C)(C)N=C(NCCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C(C)(C)C)C(=O)O)N[Si](C)(C)C(C)(C)C	3208.0	Standard non polar	33892256
Phenylalanylarginine,3TBDMS,isomer #15	CC(C)(C)[Si](C)(C)NC(=N)N(CCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C(C)(C)C)C(=O)O)[Si](C)(C)C(C)(C)C	3877.8	Semi standard non polar	33892256
Phenylalanylarginine,3TBDMS,isomer #15	CC(C)(C)[Si](C)(C)NC(=N)N(CCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C(C)(C)C)C(=O)O)[Si](C)(C)C(C)(C)C	3450.0	Standard non polar	33892256
Phenylalanylarginine,3TBDMS,isomer #16	CC(C)(C)[Si](C)(C)NC(=N)NCCC[C@@H](C(=O)O)N(C(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3795.8	Semi standard non polar	33892256
Phenylalanylarginine,3TBDMS,isomer #16	CC(C)(C)[Si](C)(C)NC(=N)NCCC[C@@H](C(=O)O)N(C(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3357.4	Standard non polar	33892256
Phenylalanylarginine,3TBDMS,isomer #17	CC(C)(C)[Si](C)(C)NC(=N)NCCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O	3997.3	Semi standard non polar	33892256
Phenylalanylarginine,3TBDMS,isomer #17	CC(C)(C)[Si](C)(C)NC(=N)NCCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O	3426.9	Standard non polar	33892256
Phenylalanylarginine,3TBDMS,isomer #18	CC(C)(C)[Si](C)(C)N(C(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[C@@H](CCCNC(=N)N)C(=O)O	3763.5	Semi standard non polar	33892256
Phenylalanylarginine,3TBDMS,isomer #18	CC(C)(C)[Si](C)(C)N(C(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[C@@H](CCCNC(=N)N)C(=O)O	3375.1	Standard non polar	33892256
Phenylalanylarginine,3TBDMS,isomer #19	CC(C)(C)[Si](C)(C)N(CCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O)C(=N)N	3915.2	Semi standard non polar	33892256
Phenylalanylarginine,3TBDMS,isomer #19	CC(C)(C)[Si](C)(C)N(CCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O)C(=N)N	3460.4	Standard non polar	33892256
Phenylalanylarginine,3TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCCNC(=N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)NC(=O)[C@@H](N)CC1=CC=CC=C1	3815.0	Semi standard non polar	33892256
Phenylalanylarginine,3TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCCNC(=N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)NC(=O)[C@@H](N)CC1=CC=CC=C1	3423.9	Standard non polar	33892256
Phenylalanylarginine,3TBDMS,isomer #20	CC(C)(C)[Si](C)(C)N=C(N)NCCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O	3820.5	Semi standard non polar	33892256
Phenylalanylarginine,3TBDMS,isomer #20	CC(C)(C)[Si](C)(C)N=C(N)NCCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O	3330.0	Standard non polar	33892256
Phenylalanylarginine,3TBDMS,isomer #21	CC(C)(C)[Si](C)(C)N[C@@H](CC1=CC=CC=C1)C(=O)N([C@@H](CCCN(C(=N)N)[Si](C)(C)C(C)(C)C)C(=O)O)[Si](C)(C)C(C)(C)C	3716.6	Semi standard non polar	33892256
Phenylalanylarginine,3TBDMS,isomer #21	CC(C)(C)[Si](C)(C)N[C@@H](CC1=CC=CC=C1)C(=O)N([C@@H](CCCN(C(=N)N)[Si](C)(C)C(C)(C)C)C(=O)O)[Si](C)(C)C(C)(C)C	3388.1	Standard non polar	33892256
Phenylalanylarginine,3TBDMS,isomer #22	CC(C)(C)[Si](C)(C)N=C(N)NCCC[C@@H](C(=O)O)N(C(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3643.0	Semi standard non polar	33892256
Phenylalanylarginine,3TBDMS,isomer #22	CC(C)(C)[Si](C)(C)N=C(N)NCCC[C@@H](C(=O)O)N(C(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3269.3	Standard non polar	33892256
Phenylalanylarginine,3TBDMS,isomer #23	CC(C)(C)[Si](C)(C)N=C(N)N(CCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C(C)(C)C)C(=O)O)[Si](C)(C)C(C)(C)C	3749.4	Semi standard non polar	33892256
Phenylalanylarginine,3TBDMS,isomer #23	CC(C)(C)[Si](C)(C)N=C(N)N(CCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C(C)(C)C)C(=O)O)[Si](C)(C)C(C)(C)C	3223.5	Standard non polar	33892256
Phenylalanylarginine,3TBDMS,isomer #24	CC(C)(C)[Si](C)(C)N=C(NCCC[C@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)C(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3800.4	Semi standard non polar	33892256
Phenylalanylarginine,3TBDMS,isomer #24	CC(C)(C)[Si](C)(C)N=C(NCCC[C@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)C(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3192.2	Standard non polar	33892256
Phenylalanylarginine,3TBDMS,isomer #25	CC(C)(C)[Si](C)(C)N(CCC[C@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)C(=O)O)C(=N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3862.2	Semi standard non polar	33892256
Phenylalanylarginine,3TBDMS,isomer #25	CC(C)(C)[Si](C)(C)N(CCC[C@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)C(=O)O)C(=N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3544.9	Standard non polar	33892256
Phenylalanylarginine,3TBDMS,isomer #26	CC(C)(C)[Si](C)(C)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[C@@H](CCCNC(=N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O	3764.1	Semi standard non polar	33892256
Phenylalanylarginine,3TBDMS,isomer #26	CC(C)(C)[Si](C)(C)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[C@@H](CCCNC(=N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O	3428.9	Standard non polar	33892256
Phenylalanylarginine,3TBDMS,isomer #27	CC(C)(C)[Si](C)(C)N=C(N[Si](C)(C)C(C)(C)C)N(CCC[C@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C(C)(C)C	3794.9	Semi standard non polar	33892256
Phenylalanylarginine,3TBDMS,isomer #27	CC(C)(C)[Si](C)(C)N=C(N[Si](C)(C)C(C)(C)C)N(CCC[C@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C(C)(C)C	3106.8	Standard non polar	33892256
Phenylalanylarginine,3TBDMS,isomer #28	CC(C)(C)[Si](C)(C)N=C(NCCC[C@@H](C(=O)O)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C	3741.7	Semi standard non polar	33892256
Phenylalanylarginine,3TBDMS,isomer #28	CC(C)(C)[Si](C)(C)N=C(NCCC[C@@H](C(=O)O)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C	3147.3	Standard non polar	33892256
Phenylalanylarginine,3TBDMS,isomer #29	CC(C)(C)[Si](C)(C)NC(=N)N(CCC[C@@H](C(=O)O)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3789.7	Semi standard non polar	33892256
Phenylalanylarginine,3TBDMS,isomer #29	CC(C)(C)[Si](C)(C)NC(=N)N(CCC[C@@H](C(=O)O)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3386.9	Standard non polar	33892256
Phenylalanylarginine,3TBDMS,isomer #3	CC(C)(C)[Si](C)(C)N=C(NCCC[C@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)C(=O)O[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C	3763.7	Semi standard non polar	33892256
Phenylalanylarginine,3TBDMS,isomer #3	CC(C)(C)[Si](C)(C)N=C(NCCC[C@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)C(=O)O[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C	3099.8	Standard non polar	33892256
Phenylalanylarginine,3TBDMS,isomer #30	CC(C)(C)[Si](C)(C)N=C(N)N(CCC[C@@H](C(=O)O)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3713.4	Semi standard non polar	33892256
Phenylalanylarginine,3TBDMS,isomer #30	CC(C)(C)[Si](C)(C)N=C(N)N(CCC[C@@H](C(=O)O)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3166.3	Standard non polar	33892256
Phenylalanylarginine,3TBDMS,isomer #4	CC(C)(C)[Si](C)(C)NC(=N)N(CCC[C@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3832.9	Semi standard non polar	33892256
Phenylalanylarginine,3TBDMS,isomer #4	CC(C)(C)[Si](C)(C)NC(=N)N(CCC[C@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3371.3	Standard non polar	33892256
Phenylalanylarginine,3TBDMS,isomer #5	CC(C)(C)[Si](C)(C)NC(=N)NCCC[C@@H](C(=O)O[Si](C)(C)C(C)(C)C)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C(C)(C)C	3773.3	Semi standard non polar	33892256
Phenylalanylarginine,3TBDMS,isomer #5	CC(C)(C)[Si](C)(C)NC(=N)NCCC[C@@H](C(=O)O[Si](C)(C)C(C)(C)C)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C(C)(C)C	3299.1	Standard non polar	33892256
Phenylalanylarginine,3TBDMS,isomer #6	CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3813.8	Semi standard non polar	33892256
Phenylalanylarginine,3TBDMS,isomer #6	CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3373.5	Standard non polar	33892256
Phenylalanylarginine,3TBDMS,isomer #7	CC(C)(C)[Si](C)(C)N[C@@H](CC1=CC=CC=C1)C(=O)N([C@@H](CCCNC(=N)N)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3645.0	Semi standard non polar	33892256
Phenylalanylarginine,3TBDMS,isomer #7	CC(C)(C)[Si](C)(C)N[C@@H](CC1=CC=CC=C1)C(=O)N([C@@H](CCCNC(=N)N)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3304.8	Standard non polar	33892256
Phenylalanylarginine,3TBDMS,isomer #8	CC(C)(C)[Si](C)(C)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CCCN(C(=N)N)[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C	3733.7	Semi standard non polar	33892256
Phenylalanylarginine,3TBDMS,isomer #8	CC(C)(C)[Si](C)(C)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CCCN(C(=N)N)[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C	3375.0	Standard non polar	33892256
Phenylalanylarginine,3TBDMS,isomer #9	CC(C)(C)[Si](C)(C)N=C(N)NCCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C	3626.4	Semi standard non polar	33892256
Phenylalanylarginine,3TBDMS,isomer #9	CC(C)(C)[Si](C)(C)N=C(N)NCCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C	3247.7	Standard non polar	33892256
Phenylalanylarginine,4TBDMS,isomer #1	CC(C)(C)[Si](C)(C)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CCCNC(=N)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	3961.8	Semi standard non polar	33892256
Phenylalanylarginine,4TBDMS,isomer #1	CC(C)(C)[Si](C)(C)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CCCNC(=N)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	3600.7	Standard non polar	33892256
Phenylalanylarginine,4TBDMS,isomer #10	CC(C)(C)[Si](C)(C)N=C(NCCC[C@@H](C(=O)O[Si](C)(C)C(C)(C)C)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C	3855.3	Semi standard non polar	33892256
Phenylalanylarginine,4TBDMS,isomer #10	CC(C)(C)[Si](C)(C)N=C(NCCC[C@@H](C(=O)O[Si](C)(C)C(C)(C)C)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C	3263.6	Standard non polar	33892256
Phenylalanylarginine,4TBDMS,isomer #11	CC(C)(C)[Si](C)(C)NC(=N)N(CCC[C@@H](C(=O)O[Si](C)(C)C(C)(C)C)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3946.4	Semi standard non polar	33892256
Phenylalanylarginine,4TBDMS,isomer #11	CC(C)(C)[Si](C)(C)NC(=N)N(CCC[C@@H](C(=O)O[Si](C)(C)C(C)(C)C)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3499.9	Standard non polar	33892256
Phenylalanylarginine,4TBDMS,isomer #12	CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCCN(C(=N)N)[Si](C)(C)C(C)(C)C)NC(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4060.8	Semi standard non polar	33892256
Phenylalanylarginine,4TBDMS,isomer #12	CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCCN(C(=N)N)[Si](C)(C)C(C)(C)C)NC(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3565.4	Standard non polar	33892256
Phenylalanylarginine,4TBDMS,isomer #13	CC(C)(C)[Si](C)(C)N=C(N)NCCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)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	3956.2	Semi standard non polar	33892256
Phenylalanylarginine,4TBDMS,isomer #13	CC(C)(C)[Si](C)(C)N=C(N)NCCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)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	3430.5	Standard non polar	33892256
Phenylalanylarginine,4TBDMS,isomer #14	CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCCNC(=N)N)N(C(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3916.5	Semi standard non polar	33892256
Phenylalanylarginine,4TBDMS,isomer #14	CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCCNC(=N)N)N(C(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3511.5	Standard non polar	33892256
Phenylalanylarginine,4TBDMS,isomer #15	CC(C)(C)[Si](C)(C)N[C@@H](CC1=CC=CC=C1)C(=O)N([C@@H](CCCN(C(=N)N)[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3856.0	Semi standard non polar	33892256
Phenylalanylarginine,4TBDMS,isomer #15	CC(C)(C)[Si](C)(C)N[C@@H](CC1=CC=CC=C1)C(=O)N([C@@H](CCCN(C(=N)N)[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3506.4	Standard non polar	33892256
Phenylalanylarginine,4TBDMS,isomer #16	CC(C)(C)[Si](C)(C)N=C(N)NCCC[C@@H](C(=O)O[Si](C)(C)C(C)(C)C)N(C(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3746.1	Semi standard non polar	33892256
Phenylalanylarginine,4TBDMS,isomer #16	CC(C)(C)[Si](C)(C)N=C(N)NCCC[C@@H](C(=O)O[Si](C)(C)C(C)(C)C)N(C(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3374.1	Standard non polar	33892256
Phenylalanylarginine,4TBDMS,isomer #17	CC(C)(C)[Si](C)(C)N=C(N)N(CCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3861.0	Semi standard non polar	33892256
Phenylalanylarginine,4TBDMS,isomer #17	CC(C)(C)[Si](C)(C)N=C(N)N(CCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3295.1	Standard non polar	33892256
Phenylalanylarginine,4TBDMS,isomer #18	CC(C)(C)[Si](C)(C)N=C(N)N(CCC[C@@H](C(=O)O[Si](C)(C)C(C)(C)C)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3856.6	Semi standard non polar	33892256
Phenylalanylarginine,4TBDMS,isomer #18	CC(C)(C)[Si](C)(C)N=C(N)N(CCC[C@@H](C(=O)O[Si](C)(C)C(C)(C)C)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3261.8	Standard non polar	33892256
Phenylalanylarginine,4TBDMS,isomer #19	CC(C)(C)[Si](C)(C)N(C(=N)NCCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)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	4157.0	Semi standard non polar	33892256
Phenylalanylarginine,4TBDMS,isomer #19	CC(C)(C)[Si](C)(C)N(C(=N)NCCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)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	3678.1	Standard non polar	33892256
Phenylalanylarginine,4TBDMS,isomer #2	CC(C)(C)[Si](C)(C)N=C(NCCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C	3910.7	Semi standard non polar	33892256
Phenylalanylarginine,4TBDMS,isomer #2	CC(C)(C)[Si](C)(C)N=C(NCCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C	3306.0	Standard non polar	33892256
Phenylalanylarginine,4TBDMS,isomer #20	CC(C)(C)[Si](C)(C)N[C@@H](CC1=CC=CC=C1)C(=O)N([C@@H](CCCNC(=N)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	3953.6	Semi standard non polar	33892256
Phenylalanylarginine,4TBDMS,isomer #20	CC(C)(C)[Si](C)(C)N[C@@H](CC1=CC=CC=C1)C(=O)N([C@@H](CCCNC(=N)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	3606.0	Standard non polar	33892256
Phenylalanylarginine,4TBDMS,isomer #21	CC(C)(C)[Si](C)(C)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CCCN(C(=N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O	4036.0	Semi standard non polar	33892256
Phenylalanylarginine,4TBDMS,isomer #21	CC(C)(C)[Si](C)(C)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CCCN(C(=N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O	3718.9	Standard non polar	33892256
Phenylalanylarginine,4TBDMS,isomer #22	CC(C)(C)[Si](C)(C)N=C(NCCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N[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	3946.8	Semi standard non polar	33892256
Phenylalanylarginine,4TBDMS,isomer #22	CC(C)(C)[Si](C)(C)N=C(NCCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N[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	3381.8	Standard non polar	33892256
Phenylalanylarginine,4TBDMS,isomer #23	CC(C)(C)[Si](C)(C)N=C(N[Si](C)(C)C(C)(C)C)N(CCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C(C)(C)C)C(=O)O)[Si](C)(C)C(C)(C)C	3932.9	Semi standard non polar	33892256
Phenylalanylarginine,4TBDMS,isomer #23	CC(C)(C)[Si](C)(C)N=C(N[Si](C)(C)C(C)(C)C)N(CCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C(C)(C)C)C(=O)O)[Si](C)(C)C(C)(C)C	3295.2	Standard non polar	33892256
Phenylalanylarginine,4TBDMS,isomer #24	CC(C)(C)[Si](C)(C)N=C(NCCC[C@@H](C(=O)O)N(C(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C	3900.2	Semi standard non polar	33892256
Phenylalanylarginine,4TBDMS,isomer #24	CC(C)(C)[Si](C)(C)N=C(NCCC[C@@H](C(=O)O)N(C(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C	3328.4	Standard non polar	33892256
Phenylalanylarginine,4TBDMS,isomer #25	CC(C)(C)[Si](C)(C)N=C(NCCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N([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	4114.2	Semi standard non polar	33892256
Phenylalanylarginine,4TBDMS,isomer #25	CC(C)(C)[Si](C)(C)N=C(NCCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N([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	3381.2	Standard non polar	33892256
Phenylalanylarginine,4TBDMS,isomer #26	CC(C)(C)[Si](C)(C)NC(=N)N(CCC[C@@H](C(=O)O)N(C(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3961.7	Semi standard non polar	33892256
Phenylalanylarginine,4TBDMS,isomer #26	CC(C)(C)[Si](C)(C)NC(=N)N(CCC[C@@H](C(=O)O)N(C(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3565.4	Standard non polar	33892256
Phenylalanylarginine,4TBDMS,isomer #27	CC(C)(C)[Si](C)(C)NC(=N)N(CCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)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	4175.0	Semi standard non polar	33892256
Phenylalanylarginine,4TBDMS,isomer #27	CC(C)(C)[Si](C)(C)NC(=N)N(CCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)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	3633.7	Standard non polar	33892256
Phenylalanylarginine,4TBDMS,isomer #28	CC(C)(C)[Si](C)(C)NC(=N)NCCC[C@@H](C(=O)O)N(C(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4079.9	Semi standard non polar	33892256
Phenylalanylarginine,4TBDMS,isomer #28	CC(C)(C)[Si](C)(C)NC(=N)NCCC[C@@H](C(=O)O)N(C(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3550.4	Standard non polar	33892256
Phenylalanylarginine,4TBDMS,isomer #29	CC(C)(C)[Si](C)(C)N(CCC[C@@H](C(=O)O)N(C(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=N)N	4021.3	Semi standard non polar	33892256
Phenylalanylarginine,4TBDMS,isomer #29	CC(C)(C)[Si](C)(C)N(CCC[C@@H](C(=O)O)N(C(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=N)N	3588.0	Standard non polar	33892256
Phenylalanylarginine,4TBDMS,isomer #3	CC(C)(C)[Si](C)(C)NC(=N)N(CCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3981.2	Semi standard non polar	33892256
Phenylalanylarginine,4TBDMS,isomer #3	CC(C)(C)[Si](C)(C)NC(=N)N(CCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3550.6	Standard non polar	33892256
Phenylalanylarginine,4TBDMS,isomer #30	CC(C)(C)[Si](C)(C)N=C(N)NCCC[C@@H](C(=O)O)N(C(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3947.1	Semi standard non polar	33892256
Phenylalanylarginine,4TBDMS,isomer #30	CC(C)(C)[Si](C)(C)N=C(N)NCCC[C@@H](C(=O)O)N(C(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3468.4	Standard non polar	33892256
Phenylalanylarginine,4TBDMS,isomer #31	CC(C)(C)[Si](C)(C)N=C(N)N(CCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)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	4089.3	Semi standard non polar	33892256
Phenylalanylarginine,4TBDMS,isomer #31	CC(C)(C)[Si](C)(C)N=C(N)N(CCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)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	3399.1	Standard non polar	33892256
Phenylalanylarginine,4TBDMS,isomer #32	CC(C)(C)[Si](C)(C)N=C(N)N(CCC[C@@H](C(=O)O)N(C(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3890.5	Semi standard non polar	33892256
Phenylalanylarginine,4TBDMS,isomer #32	CC(C)(C)[Si](C)(C)N=C(N)N(CCC[C@@H](C(=O)O)N(C(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3345.2	Standard non polar	33892256
Phenylalanylarginine,4TBDMS,isomer #33	CC(C)(C)[Si](C)(C)N=C(N(CCC[C@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)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	4008.8	Semi standard non polar	33892256
Phenylalanylarginine,4TBDMS,isomer #33	CC(C)(C)[Si](C)(C)N=C(N(CCC[C@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)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	3397.8	Standard non polar	33892256
Phenylalanylarginine,4TBDMS,isomer #34	CC(C)(C)[Si](C)(C)N=C(NCCC[C@@H](C(=O)O)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3902.6	Semi standard non polar	33892256
Phenylalanylarginine,4TBDMS,isomer #34	CC(C)(C)[Si](C)(C)N=C(NCCC[C@@H](C(=O)O)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3304.5	Standard non polar	33892256
Phenylalanylarginine,4TBDMS,isomer #35	CC(C)(C)[Si](C)(C)N(CCC[C@@H](C(=O)O)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C(C)(C)C)C(=N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3975.8	Semi standard non polar	33892256
Phenylalanylarginine,4TBDMS,isomer #35	CC(C)(C)[Si](C)(C)N(CCC[C@@H](C(=O)O)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C(C)(C)C)C(=N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3639.9	Standard non polar	33892256
Phenylalanylarginine,4TBDMS,isomer #36	CC(C)(C)[Si](C)(C)N=C(N[Si](C)(C)C(C)(C)C)N(CCC[C@@H](C(=O)O)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3907.1	Semi standard non polar	33892256
Phenylalanylarginine,4TBDMS,isomer #36	CC(C)(C)[Si](C)(C)N=C(N[Si](C)(C)C(C)(C)C)N(CCC[C@@H](C(=O)O)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3227.7	Standard non polar	33892256
Phenylalanylarginine,4TBDMS,isomer #4	CC(C)(C)[Si](C)(C)NC(=N)NCCC[C@@H](C(=O)O[Si](C)(C)C(C)(C)C)N(C(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3913.7	Semi standard non polar	33892256
Phenylalanylarginine,4TBDMS,isomer #4	CC(C)(C)[Si](C)(C)NC(=N)NCCC[C@@H](C(=O)O[Si](C)(C)C(C)(C)C)N(C(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3484.5	Standard non polar	33892256
Phenylalanylarginine,4TBDMS,isomer #5	CC(C)(C)[Si](C)(C)NC(=N)NCCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)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	4134.0	Semi standard non polar	33892256
Phenylalanylarginine,4TBDMS,isomer #5	CC(C)(C)[Si](C)(C)NC(=N)NCCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)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	3544.1	Standard non polar	33892256
Phenylalanylarginine,4TBDMS,isomer #6	CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCCN(C(=N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)NC(=O)[C@@H](N)CC1=CC=CC=C1	4006.4	Semi standard non polar	33892256
Phenylalanylarginine,4TBDMS,isomer #6	CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCCN(C(=N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)NC(=O)[C@@H](N)CC1=CC=CC=C1	3625.9	Standard non polar	33892256
Phenylalanylarginine,4TBDMS,isomer #7	CC(C)(C)[Si](C)(C)N=C(NCCC[C@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)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	3910.6	Semi standard non polar	33892256
Phenylalanylarginine,4TBDMS,isomer #7	CC(C)(C)[Si](C)(C)N=C(NCCC[C@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)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	3267.2	Standard non polar	33892256
Phenylalanylarginine,4TBDMS,isomer #8	CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCCNC(=N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C(C)(C)C	3920.1	Semi standard non polar	33892256
Phenylalanylarginine,4TBDMS,isomer #8	CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCCNC(=N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C(C)(C)C	3538.9	Standard non polar	33892256
Phenylalanylarginine,4TBDMS,isomer #9	CC(C)(C)[Si](C)(C)N=C(N[Si](C)(C)C(C)(C)C)N(CCC[C@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3893.0	Semi standard non polar	33892256
Phenylalanylarginine,4TBDMS,isomer #9	CC(C)(C)[Si](C)(C)N=C(N[Si](C)(C)C(C)(C)C)N(CCC[C@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3178.0	Standard non polar	33892256
Phenylalanylarginine,5TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCCNC(=N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)NC(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4271.0	Semi standard non polar	33892256
Phenylalanylarginine,5TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCCNC(=N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)NC(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3795.1	Standard non polar	33892256
Phenylalanylarginine,5TBDMS,isomer #10	CC(C)(C)[Si](C)(C)NC(=N)NCCC[C@@H](C(=O)O[Si](C)(C)C(C)(C)C)N(C(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4206.8	Semi standard non polar	33892256
Phenylalanylarginine,5TBDMS,isomer #10	CC(C)(C)[Si](C)(C)NC(=N)NCCC[C@@H](C(=O)O[Si](C)(C)C(C)(C)C)N(C(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3700.9	Standard non polar	33892256
Phenylalanylarginine,5TBDMS,isomer #11	CC(C)(C)[Si](C)(C)N=C(N(CCC[C@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)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	4122.6	Semi standard non polar	33892256
Phenylalanylarginine,5TBDMS,isomer #11	CC(C)(C)[Si](C)(C)N=C(N(CCC[C@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)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	3495.1	Standard non polar	33892256
Phenylalanylarginine,5TBDMS,isomer #12	CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCCN(C(=N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C(C)(C)C	4132.4	Semi standard non polar	33892256
Phenylalanylarginine,5TBDMS,isomer #12	CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCCN(C(=N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C(C)(C)C	3747.3	Standard non polar	33892256
Phenylalanylarginine,5TBDMS,isomer #13	CC(C)(C)[Si](C)(C)N=C(NCCC[C@@H](C(=O)O[Si](C)(C)C(C)(C)C)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4030.2	Semi standard non polar	33892256
Phenylalanylarginine,5TBDMS,isomer #13	CC(C)(C)[Si](C)(C)N=C(NCCC[C@@H](C(=O)O[Si](C)(C)C(C)(C)C)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3427.2	Standard non polar	33892256
Phenylalanylarginine,5TBDMS,isomer #14	CC(C)(C)[Si](C)(C)N=C(N[Si](C)(C)C(C)(C)C)N(CCC[C@@H](C(=O)O[Si](C)(C)C(C)(C)C)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4016.1	Semi standard non polar	33892256
Phenylalanylarginine,5TBDMS,isomer #14	CC(C)(C)[Si](C)(C)N=C(N[Si](C)(C)C(C)(C)C)N(CCC[C@@H](C(=O)O[Si](C)(C)C(C)(C)C)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3352.2	Standard non polar	33892256
Phenylalanylarginine,5TBDMS,isomer #15	CC(C)(C)[Si](C)(C)N=C(N)N(CCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)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)[Si](C)(C)C(C)(C)C	4224.3	Semi standard non polar	33892256
Phenylalanylarginine,5TBDMS,isomer #15	CC(C)(C)[Si](C)(C)N=C(N)N(CCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)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)[Si](C)(C)C(C)(C)C	3515.2	Standard non polar	33892256
Phenylalanylarginine,5TBDMS,isomer #16	CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCCN(C(=N)N)[Si](C)(C)C(C)(C)C)N(C(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4176.5	Semi standard non polar	33892256
Phenylalanylarginine,5TBDMS,isomer #16	CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCCN(C(=N)N)[Si](C)(C)C(C)(C)C)N(C(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3726.1	Standard non polar	33892256
Phenylalanylarginine,5TBDMS,isomer #17	CC(C)(C)[Si](C)(C)N=C(N)NCCC[C@@H](C(=O)O[Si](C)(C)C(C)(C)C)N(C(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4086.3	Semi standard non polar	33892256
Phenylalanylarginine,5TBDMS,isomer #17	CC(C)(C)[Si](C)(C)N=C(N)NCCC[C@@H](C(=O)O[Si](C)(C)C(C)(C)C)N(C(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3608.6	Standard non polar	33892256
Phenylalanylarginine,5TBDMS,isomer #18	CC(C)(C)[Si](C)(C)N=C(N)N(CCC[C@@H](C(=O)O[Si](C)(C)C(C)(C)C)N(C(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3988.8	Semi standard non polar	33892256
Phenylalanylarginine,5TBDMS,isomer #18	CC(C)(C)[Si](C)(C)N=C(N)N(CCC[C@@H](C(=O)O[Si](C)(C)C(C)(C)C)N(C(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3464.9	Standard non polar	33892256
Phenylalanylarginine,5TBDMS,isomer #19	CC(C)(C)[Si](C)(C)N=C(NCCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N([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	4277.8	Semi standard non polar	33892256
Phenylalanylarginine,5TBDMS,isomer #19	CC(C)(C)[Si](C)(C)N=C(NCCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N([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	3574.7	Standard non polar	33892256
Phenylalanylarginine,5TBDMS,isomer #2	CC(C)(C)[Si](C)(C)N[C@@H](CC1=CC=CC=C1)C(=O)N([C@@H](CCCNC(=N)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)[Si](C)(C)C(C)(C)C	4050.9	Semi standard non polar	33892256
Phenylalanylarginine,5TBDMS,isomer #2	CC(C)(C)[Si](C)(C)N[C@@H](CC1=CC=CC=C1)C(=O)N([C@@H](CCCNC(=N)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)[Si](C)(C)C(C)(C)C	3738.7	Standard non polar	33892256
Phenylalanylarginine,5TBDMS,isomer #20	CC(C)(C)[Si](C)(C)N(CCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O)C(=N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4365.1	Semi standard non polar	33892256
Phenylalanylarginine,5TBDMS,isomer #20	CC(C)(C)[Si](C)(C)N(CCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O)C(=N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3886.7	Standard non polar	33892256
Phenylalanylarginine,5TBDMS,isomer #21	CC(C)(C)[Si](C)(C)N(C(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[C@@H](CCCNC(=N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O	4239.2	Semi standard non polar	33892256
Phenylalanylarginine,5TBDMS,isomer #21	CC(C)(C)[Si](C)(C)N(C(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[C@@H](CCCNC(=N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O	3808.6	Standard non polar	33892256
Phenylalanylarginine,5TBDMS,isomer #22	CC(C)(C)[Si](C)(C)N[C@@H](CC1=CC=CC=C1)C(=O)N([C@@H](CCCN(C(=N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O)[Si](C)(C)C(C)(C)C	4163.8	Semi standard non polar	33892256
Phenylalanylarginine,5TBDMS,isomer #22	CC(C)(C)[Si](C)(C)N[C@@H](CC1=CC=CC=C1)C(=O)N([C@@H](CCCN(C(=N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O)[Si](C)(C)C(C)(C)C	3820.8	Standard non polar	33892256
Phenylalanylarginine,5TBDMS,isomer #23	CC(C)(C)[Si](C)(C)N=C(NCCC[C@@H](C(=O)O)N(C(=O)[C@H](CC1=CC=CC=C1)N[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	4069.4	Semi standard non polar	33892256
Phenylalanylarginine,5TBDMS,isomer #23	CC(C)(C)[Si](C)(C)N=C(NCCC[C@@H](C(=O)O)N(C(=O)[C@H](CC1=CC=CC=C1)N[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	3520.5	Standard non polar	33892256
Phenylalanylarginine,5TBDMS,isomer #24	CC(C)(C)[Si](C)(C)N=C(N(CCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C(C)(C)C)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	4161.6	Semi standard non polar	33892256
Phenylalanylarginine,5TBDMS,isomer #24	CC(C)(C)[Si](C)(C)N=C(N(CCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C(C)(C)C)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	3601.3	Standard non polar	33892256
Phenylalanylarginine,5TBDMS,isomer #25	CC(C)(C)[Si](C)(C)N=C(N[Si](C)(C)C(C)(C)C)N(CCC[C@@H](C(=O)O)N(C(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4061.6	Semi standard non polar	33892256
Phenylalanylarginine,5TBDMS,isomer #25	CC(C)(C)[Si](C)(C)N=C(N[Si](C)(C)C(C)(C)C)N(CCC[C@@H](C(=O)O)N(C(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3447.2	Standard non polar	33892256
Phenylalanylarginine,5TBDMS,isomer #26	CC(C)(C)[Si](C)(C)N=C(N[Si](C)(C)C(C)(C)C)N(CCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)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	4282.7	Semi standard non polar	33892256
Phenylalanylarginine,5TBDMS,isomer #26	CC(C)(C)[Si](C)(C)N=C(N[Si](C)(C)C(C)(C)C)N(CCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)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	3500.9	Standard non polar	33892256
Phenylalanylarginine,5TBDMS,isomer #27	CC(C)(C)[Si](C)(C)N=C(NCCC[C@@H](C(=O)O)N(C(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C	4196.8	Semi standard non polar	33892256
Phenylalanylarginine,5TBDMS,isomer #27	CC(C)(C)[Si](C)(C)N=C(NCCC[C@@H](C(=O)O)N(C(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C	3562.8	Standard non polar	33892256
Phenylalanylarginine,5TBDMS,isomer #28	CC(C)(C)[Si](C)(C)NC(=N)N(CCC[C@@H](C(=O)O)N(C(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4263.3	Semi standard non polar	33892256
Phenylalanylarginine,5TBDMS,isomer #28	CC(C)(C)[Si](C)(C)NC(=N)N(CCC[C@@H](C(=O)O)N(C(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3775.8	Standard non polar	33892256
Phenylalanylarginine,5TBDMS,isomer #29	CC(C)(C)[Si](C)(C)N=C(N)N(CCC[C@@H](C(=O)O)N(C(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4220.1	Semi standard non polar	33892256
Phenylalanylarginine,5TBDMS,isomer #29	CC(C)(C)[Si](C)(C)N=C(N)N(CCC[C@@H](C(=O)O)N(C(=O)[C@H](CC1=CC=CC=C1)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3567.8	Standard non polar	33892256
Phenylalanylarginine,5TBDMS,isomer #3	CC(C)(C)[Si](C)(C)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CCCN(C(=N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C	4153.7	Semi standard non polar	33892256
Phenylalanylarginine,5TBDMS,isomer #3	CC(C)(C)[Si](C)(C)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CCCN(C(=N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C	3795.4	Standard non polar	33892256
Phenylalanylarginine,5TBDMS,isomer #30	CC(C)(C)[Si](C)(C)N=C(N(CCC[C@@H](C(=O)O)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[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	4127.1	Semi standard non polar	33892256
Phenylalanylarginine,5TBDMS,isomer #30	CC(C)(C)[Si](C)(C)N=C(N(CCC[C@@H](C(=O)O)N(C(=O)[C@@H](N)CC1=CC=CC=C1)[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	3519.3	Standard non polar	33892256
Phenylalanylarginine,5TBDMS,isomer #4	CC(C)(C)[Si](C)(C)N=C(NCCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C(C)(C)C)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	4016.6	Semi standard non polar	33892256
Phenylalanylarginine,5TBDMS,isomer #4	CC(C)(C)[Si](C)(C)N=C(NCCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C(C)(C)C)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	3484.9	Standard non polar	33892256
Phenylalanylarginine,5TBDMS,isomer #5	CC(C)(C)[Si](C)(C)N=C(N[Si](C)(C)C(C)(C)C)N(CCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3999.6	Semi standard non polar	33892256
Phenylalanylarginine,5TBDMS,isomer #5	CC(C)(C)[Si](C)(C)N=C(N[Si](C)(C)C(C)(C)C)N(CCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3405.3	Standard non polar	33892256
Phenylalanylarginine,5TBDMS,isomer #6	CC(C)(C)[Si](C)(C)N=C(NCCC[C@@H](C(=O)O[Si](C)(C)C(C)(C)C)N(C(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C	3979.3	Semi standard non polar	33892256
Phenylalanylarginine,5TBDMS,isomer #6	CC(C)(C)[Si](C)(C)N=C(NCCC[C@@H](C(=O)O[Si](C)(C)C(C)(C)C)N(C(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C	3484.3	Standard non polar	33892256
Phenylalanylarginine,5TBDMS,isomer #7	CC(C)(C)[Si](C)(C)N=C(NCCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)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)N[Si](C)(C)C(C)(C)C	4212.6	Semi standard non polar	33892256
Phenylalanylarginine,5TBDMS,isomer #7	CC(C)(C)[Si](C)(C)N=C(NCCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)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)N[Si](C)(C)C(C)(C)C	3534.6	Standard non polar	33892256
Phenylalanylarginine,5TBDMS,isomer #8	CC(C)(C)[Si](C)(C)NC(=N)N(CCC[C@@H](C(=O)O[Si](C)(C)C(C)(C)C)N(C(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4074.1	Semi standard non polar	33892256
Phenylalanylarginine,5TBDMS,isomer #8	CC(C)(C)[Si](C)(C)NC(=N)N(CCC[C@@H](C(=O)O[Si](C)(C)C(C)(C)C)N(C(=O)[C@H](CC1=CC=CC=C1)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3701.5	Standard non polar	33892256
Phenylalanylarginine,5TBDMS,isomer #9	CC(C)(C)[Si](C)(C)NC(=N)N(CCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)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)[Si](C)(C)C(C)(C)C	4288.2	Semi standard non polar	33892256
Phenylalanylarginine,5TBDMS,isomer #9	CC(C)(C)[Si](C)(C)NC(=N)N(CCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)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)[Si](C)(C)C(C)(C)C	3750.7	Standard non polar	33892256

Spectra

GC-MS Spectra

Spectrum Type	Description	Splash Key	Deposition Date	Source	View
Predicted GC-MS	Predicted GC-MS Spectrum - Phenylalanylarginine 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 - Phenylalanylarginine 10V, Negative-QTOF	splash10-00di-0159000000-6e593d73d2329c5c25f7	2021-09-23	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Phenylalanylarginine 20V, Negative-QTOF	splash10-03dl-4593000000-f0474acc6832097b04c1	2021-09-23	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Phenylalanylarginine 40V, Negative-QTOF	splash10-0006-9200000000-455af525a97988ad5dd0	2021-09-23	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Phenylalanylarginine 10V, Positive-QTOF	splash10-00di-0209000000-71d669974b9071447ae3	2021-09-25	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Phenylalanylarginine 20V, Positive-QTOF	splash10-006x-8920000000-34343921431428658593	2021-09-25	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Phenylalanylarginine 40V, Positive-QTOF	splash10-0006-9800000000-6d9e9429bf11287998a5	2021-09-25	Wishart Lab	View Spectrum

NMR Spectra

Spectrum Type	Description	Deposition Date	Source	View
Predicted 1D NMR	¹³C NMR Spectrum (1D, 100 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 100 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 200 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 200 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 300 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 300 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 400 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 400 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 500 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 500 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 600 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 600 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 700 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 700 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 800 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 800 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 900 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 900 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 1000 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 1000 MHz, D₂O, predicted)	2021-09-16	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

FDB112009

KNApSAcK ID

Not Available

Chemspider ID

133005

KEGG Compound ID

Not Available

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Not Available

METLIN ID

Not Available

PubChem Compound

150903

PDB ID

Not Available

ChEBI ID

73632

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

Schug KA, Lindner W, Lemr K: Isomeric discrimination of arginine-containing dipeptides using electrospray ionization-ion trap mass spectrometry and the kinetic method. J Am Soc Mass Spectrom. 2004 Jun;15(6):840-7. [PubMed:15144973 ]
Hawthorne SJ, Halton DW, Walker B: Identification and characterization of the cysteine and serine proteinases of the trematode, Haplometra cylindracea and determination of their haemoglobinase activity. Parasitology. 1994 Jun;108 ( Pt 5):595-601. [PubMed:8052515 ]

Showing metabocard for Phenylalanylarginine (HMDB0028989)

MOL for HMDB0028989 (Phenylalanylarginine)

3D MOL for HMDB0028989 (Phenylalanylarginine)

3D SDF for HMDB0028989 (Phenylalanylarginine)

3D-SDF for HMDB0028989 (Phenylalanylarginine)

PDB for HMDB0028989 (Phenylalanylarginine)

3D PDB for HMDB0028989 (Phenylalanylarginine)

SMILES for HMDB0028989 (Phenylalanylarginine)

INCHI for HMDB0028989 (Phenylalanylarginine)

Structure for HMDB0028989 (Phenylalanylarginine)

3D Structure for HMDB0028989 (Phenylalanylarginine)

Predicted Collision Cross Sections

Predicted Kovats Retention Indices

Underivatized

Derivatized

GC-MS Spectra

MS/MS Spectra

NMR Spectra