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Record Information

Version

5.0

Status

Expected but not Quantified

Creation Date

2021-08-27 01:17:06 UTC

Update Date

2021-09-14 15:15:55 UTC

HMDB ID

HMDB0242138

Secondary Accession Numbers

None

Metabolite Identification

Common Name

(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid

Description

(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid, also known as fructose lysine, belongs to the class of organic compounds known as d-alpha-amino acids. These are alpha amino acids which have the D-configuration of the alpha-carbon atom. Based on a literature review very few articles have been published on (2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid.

Structure

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

HMDB0242138
     RDKit          3D
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid
 45 44  0  0  0  0  0  0  0  0999 V2000
   -5.7789   -1.6765    1.2057 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6640   -1.4392   -0.2089 C   0  0  2  0  0  0  0  0  0  0  0  0
   -4.3788   -0.6922   -0.5549 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1678   -1.4717   -0.1305 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8826   -0.7837   -0.4526 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7252    0.5608    0.2013 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4818    1.1913   -0.1332 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.6794    0.5423    0.4128 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9059    1.2634    0.0252 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8027    2.2641   -0.6632 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2720    0.8505    0.4195 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.1717   -0.3019    1.1959 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.1276    0.6055   -0.7909 C   0  0  2  0  0  0  0  0  0  0  0  0
    3.5858   -0.4099   -1.5744 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5429    0.2725   -0.4782 C   0  0  2  0  0  0  0  0  0  0  0  0
    5.6938   -0.9189    0.2172 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.2591    1.3561    0.2887 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6053    1.0058    0.3785 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7908   -0.6115   -0.6827 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9248   -0.2690   -1.8826 O   0  0  0  0  0  0  0  0  0  0  0  0
   -7.7841   -0.1589    0.1963 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3383   -0.8908    1.7386 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8078   -1.6153    1.4372 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6486   -2.3973   -0.7564 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3761   -0.5756   -1.6606 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3880    0.3133   -0.1259 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1632   -2.4780   -0.6065 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2485   -1.6740    0.9659 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0179   -1.4194   -0.1468 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7752   -0.6670   -1.5556 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5775    1.2122   -0.0739 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7796    0.4687    1.3191 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5105    2.1831    0.1721 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7751   -0.4991    0.0446 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6204    0.5285    1.5228 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6946    1.6329    1.0816 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4082   -1.1165    0.6963 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0846    1.5227   -1.4217 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9360   -1.2799   -1.2694 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.0926    0.1740   -1.4556 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4792   -0.8733    0.8113 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.1817    2.3429   -0.1729 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.8693    1.3514    1.3448 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.1943    1.7622    0.6070 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.7719    0.8152    0.5151 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  9 10  2  0
  9 11  1  0
 11 12  1  0
 11 13  1  0
 13 14  1  0
 13 15  1  0
 15 16  1  0
 15 17  1  0
 17 18  1  0
  2 19  1  0
 19 20  2  0
 19 21  1  0
  1 22  1  0
  1 23  1  0
  2 24  1  6
  3 25  1  0
  3 26  1  0
  4 27  1  0
  4 28  1  0
  5 29  1  0
  5 30  1  0
  6 31  1  0
  6 32  1  0
  7 33  1  0
  8 34  1  0
  8 35  1  0
 11 36  1  1
 12 37  1  0
 13 38  1  6
 14 39  1  0
 15 40  1  6
 16 41  1  0
 17 42  1  0
 17 43  1  0
 18 44  1  0
 21 45  1  0
M  END

  Mrv1652308272103272D          

 25 24  0  0  1  0            999 V2000
   10.1427    2.5559    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4283    2.1434    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8572    2.1434    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7138    2.5559    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2849    2.5559    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7125    2.1434    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5717    2.5559    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    6.5704    2.1434    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4270    2.5559    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    5.8559    2.5559    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    5.1414    2.1434    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   12.2862    2.1434    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5717    3.3809    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.9993    2.1434    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.9980    2.5559    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.5704    1.3184    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.4270    3.3809    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.8559    3.3809    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.1414    1.3184    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.0006    2.5559    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.2862    1.3184    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.5717    1.7309    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4270    1.7309    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.8559    1.7309    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1414    2.9684    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  2  1  0  0  0  0
  7  3  1  0  0  0  0
  8  5  1  0  0  0  0
  9  6  1  0  0  0  0
 10  8  1  0  0  0  0
 11  9  1  0  0  0  0
 11 10  1  0  0  0  0
 12  7  1  0  0  0  0
  7 13  1  6  0  0  0
 14  4  1  0  0  0  0
 14  5  1  0  0  0  0
 15  6  1  0  0  0  0
 16  8  2  0  0  0  0
  9 17  1  6  0  0  0
 10 18  1  1  0  0  0
 11 19  1  1  0  0  0
 20 12  2  0  0  0  0
 21 12  1  0  0  0  0
  7 22  1  6  0  0  0
  9 23  1  6  0  0  0
 10 24  1  1  0  0  0
 11 25  1  1  0  0  0
M  END
> <DATABASE_ID>
HMDB0242138

> <DATABASE_NAME>
hmdb

> <SMILES>
[H][C@@](N)(CCCCNCC(=O)[C@@]([H])(O)[C@]([H])(O)[C@]([H])(O)CO)C(O)=O

> <INCHI_IDENTIFIER>
InChI=1S/C12H24N2O7/c13-7(12(20)21)3-1-2-4-14-5-8(16)10(18)11(19)9(17)6-15/h7,9-11,14-15,17-19H,1-6,13H2,(H,20,21)/t7-,9-,10-,11-/m1/s1

> <INCHI_KEY>
BFSYFTQDGRDJNV-QCNRFFRDSA-N

> <FORMULA>
C12H24N2O7

> <MOLECULAR_WEIGHT>
308.331

> <EXACT_MASS>
308.158351121

> <JCHEM_ACCEPTOR_COUNT>
9

> <JCHEM_ATOM_COUNT>
45

> <JCHEM_AVERAGE_POLARIZABILITY>
31.239547070635616

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
7

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
(2R)-2-amino-6-{[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino}hexanoic acid

> <ALOGPS_LOGP>
-2.93

> <JCHEM_LOGP>
-5.489549887517673

> <ALOGPS_LOGS>
-0.91

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
1

> <JCHEM_PKA>
10.566939799692467

> <JCHEM_PKA_STRONGEST_ACIDIC>
2.2424727413798884

> <JCHEM_PKA_STRONGEST_BASIC>
9.321590571141122

> <JCHEM_POLAR_SURFACE_AREA>
173.33999999999997

> <JCHEM_REFRACTIVITY>
71.88459999999999

> <JCHEM_ROTATABLE_BOND_COUNT>
12

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
3.81e+01 g/l

> <JCHEM_TRADITIONAL_IUPAC>
(2R)-2-amino-6-{[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino}hexanoic acid

> <JCHEM_VEBER_RULE>
0

$$$$

HMDB0242138
     RDKit          3D
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid
 45 44  0  0  0  0  0  0  0  0999 V2000
   -5.7789   -1.6765    1.2057 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6640   -1.4392   -0.2089 C   0  0  2  0  0  0  0  0  0  0  0  0
   -4.3788   -0.6922   -0.5549 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1678   -1.4717   -0.1305 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8826   -0.7837   -0.4526 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7252    0.5608    0.2013 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4818    1.1913   -0.1332 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.6794    0.5423    0.4128 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9059    1.2634    0.0252 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8027    2.2641   -0.6632 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2720    0.8505    0.4195 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.1717   -0.3019    1.1959 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.1276    0.6055   -0.7909 C   0  0  2  0  0  0  0  0  0  0  0  0
    3.5858   -0.4099   -1.5744 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5429    0.2725   -0.4782 C   0  0  2  0  0  0  0  0  0  0  0  0
    5.6938   -0.9189    0.2172 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.2591    1.3561    0.2887 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6053    1.0058    0.3785 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7908   -0.6115   -0.6827 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9248   -0.2690   -1.8826 O   0  0  0  0  0  0  0  0  0  0  0  0
   -7.7841   -0.1589    0.1963 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3383   -0.8908    1.7386 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8078   -1.6153    1.4372 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6486   -2.3973   -0.7564 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3761   -0.5756   -1.6606 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3880    0.3133   -0.1259 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1632   -2.4780   -0.6065 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2485   -1.6740    0.9659 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0179   -1.4194   -0.1468 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7752   -0.6670   -1.5556 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5775    1.2122   -0.0739 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7796    0.4687    1.3191 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5105    2.1831    0.1721 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7751   -0.4991    0.0446 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6204    0.5285    1.5228 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6946    1.6329    1.0816 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4082   -1.1165    0.6963 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0846    1.5227   -1.4217 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9360   -1.2799   -1.2694 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.0926    0.1740   -1.4556 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4792   -0.8733    0.8113 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.1817    2.3429   -0.1729 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.8693    1.3514    1.3448 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.1943    1.7622    0.6070 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.7719    0.8152    0.5151 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  9 10  2  0
  9 11  1  0
 11 12  1  0
 11 13  1  0
 13 14  1  0
 13 15  1  0
 15 16  1  0
 15 17  1  0
 17 18  1  0
  2 19  1  0
 19 20  2  0
 19 21  1  0
  1 22  1  0
  1 23  1  0
  2 24  1  6
  3 25  1  0
  3 26  1  0
  4 27  1  0
  4 28  1  0
  5 29  1  0
  5 30  1  0
  6 31  1  0
  6 32  1  0
  7 33  1  0
  8 34  1  0
  8 35  1  0
 11 36  1  1
 12 37  1  0
 13 38  1  6
 14 39  1  0
 15 40  1  6
 16 41  1  0
 17 42  1  0
 17 43  1  0
 18 44  1  0
 21 45  1  0
M  END

HEADER    PROTEIN                                 27-AUG-21   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   27-AUG-21         0                                  
HETATM    1  C   UNK     0      18.933   4.771   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0      17.599   4.001   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0      20.267   4.001   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0      16.266   4.771   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0      13.598   4.771   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0       6.930   4.001   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0      21.600   4.771   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0      12.265   4.001   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0       8.264   4.771   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0      10.931   4.771   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0       9.597   4.001   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0      22.934   4.001   0.000  0.00  0.00           C+0
HETATM   13  N   UNK     0      21.600   6.311   0.000  0.00  0.00           N+0
HETATM   14  N   UNK     0      14.932   4.001   0.000  0.00  0.00           N+0
HETATM   15  O   UNK     0       5.596   4.771   0.000  0.00  0.00           O+0
HETATM   16  O   UNK     0      12.265   2.461   0.000  0.00  0.00           O+0
HETATM   17  O   UNK     0       8.264   6.311   0.000  0.00  0.00           O+0
HETATM   18  O   UNK     0      10.931   6.311   0.000  0.00  0.00           O+0
HETATM   19  O   UNK     0       9.597   2.461   0.000  0.00  0.00           O+0
HETATM   20  O   UNK     0      24.268   4.771   0.000  0.00  0.00           O+0
HETATM   21  O   UNK     0      22.934   2.461   0.000  0.00  0.00           O+0
HETATM   22  H   UNK     0      21.600   3.231   0.000  0.00  0.00           H+0
HETATM   23  H   UNK     0       8.264   3.231   0.000  0.00  0.00           H+0
HETATM   24  H   UNK     0      10.931   3.231   0.000  0.00  0.00           H+0
HETATM   25  H   UNK     0       9.597   5.541   0.000  0.00  0.00           H+0
CONECT    1    2    3                                                       
CONECT    2    1    4                                                       
CONECT    3    1    7                                                       
CONECT    4    2   14                                                       
CONECT    5    8   14                                                       
CONECT    6    9   15                                                       
CONECT    7    3   12   13   22                                             
CONECT    8    5   10   16                                                  
CONECT    9    6   11   17   23                                             
CONECT   10    8   11   18   24                                             
CONECT   11    9   10   19   25                                             
CONECT   12    7   20   21                                                  
CONECT   13    7                                                            
CONECT   14    4    5                                                       
CONECT   15    6                                                            
CONECT   16    8                                                            
CONECT   17    9                                                            
CONECT   18   10                                                            
CONECT   19   11                                                            
CONECT   20   12                                                            
CONECT   21   12                                                            
CONECT   22    7                                                            
CONECT   23    9                                                            
CONECT   24   10                                                            
CONECT   25   11                                                            
MASTER        0    0    0    0    0    0    0    0   25    0   48    0
END

COMPND    HMDB0242138
HETATM    1  N1  UNL     1      -5.779  -1.677   1.206  1.00  0.00           N  
HETATM    2  C1  UNL     1      -5.664  -1.439  -0.209  1.00  0.00           C  
HETATM    3  C2  UNL     1      -4.379  -0.692  -0.555  1.00  0.00           C  
HETATM    4  C3  UNL     1      -3.168  -1.472  -0.130  1.00  0.00           C  
HETATM    5  C4  UNL     1      -1.883  -0.784  -0.453  1.00  0.00           C  
HETATM    6  C5  UNL     1      -1.725   0.561   0.201  1.00  0.00           C  
HETATM    7  N2  UNL     1      -0.482   1.191  -0.133  1.00  0.00           N  
HETATM    8  C6  UNL     1       0.679   0.542   0.413  1.00  0.00           C  
HETATM    9  C7  UNL     1       1.906   1.263   0.025  1.00  0.00           C  
HETATM   10  O1  UNL     1       1.803   2.264  -0.663  1.00  0.00           O  
HETATM   11  C8  UNL     1       3.272   0.851   0.420  1.00  0.00           C  
HETATM   12  O2  UNL     1       3.172  -0.302   1.196  1.00  0.00           O  
HETATM   13  C9  UNL     1       4.128   0.605  -0.791  1.00  0.00           C  
HETATM   14  O3  UNL     1       3.586  -0.410  -1.574  1.00  0.00           O  
HETATM   15  C10 UNL     1       5.543   0.273  -0.478  1.00  0.00           C  
HETATM   16  O4  UNL     1       5.694  -0.919   0.217  1.00  0.00           O  
HETATM   17  C11 UNL     1       6.259   1.356   0.289  1.00  0.00           C  
HETATM   18  O5  UNL     1       7.605   1.006   0.378  1.00  0.00           O  
HETATM   19  C12 UNL     1      -6.791  -0.612  -0.683  1.00  0.00           C  
HETATM   20  O6  UNL     1      -6.925  -0.269  -1.883  1.00  0.00           O  
HETATM   21  O7  UNL     1      -7.784  -0.159   0.196  1.00  0.00           O  
HETATM   22  H1  UNL     1      -5.338  -0.891   1.739  1.00  0.00           H  
HETATM   23  H2  UNL     1      -6.808  -1.615   1.437  1.00  0.00           H  
HETATM   24  H3  UNL     1      -5.649  -2.397  -0.756  1.00  0.00           H  
HETATM   25  H4  UNL     1      -4.376  -0.576  -1.661  1.00  0.00           H  
HETATM   26  H5  UNL     1      -4.388   0.313  -0.126  1.00  0.00           H  
HETATM   27  H6  UNL     1      -3.163  -2.478  -0.607  1.00  0.00           H  
HETATM   28  H7  UNL     1      -3.249  -1.674   0.966  1.00  0.00           H  
HETATM   29  H8  UNL     1      -1.018  -1.419  -0.147  1.00  0.00           H  
HETATM   30  H9  UNL     1      -1.775  -0.667  -1.556  1.00  0.00           H  
HETATM   31  H10 UNL     1      -2.577   1.212  -0.074  1.00  0.00           H  
HETATM   32  H11 UNL     1      -1.780   0.469   1.319  1.00  0.00           H  
HETATM   33  H12 UNL     1      -0.511   2.183   0.172  1.00  0.00           H  
HETATM   34  H13 UNL     1       0.775  -0.499   0.045  1.00  0.00           H  
HETATM   35  H14 UNL     1       0.620   0.529   1.523  1.00  0.00           H  
HETATM   36  H15 UNL     1       3.695   1.633   1.082  1.00  0.00           H  
HETATM   37  H16 UNL     1       3.408  -1.116   0.696  1.00  0.00           H  
HETATM   38  H17 UNL     1       4.085   1.523  -1.422  1.00  0.00           H  
HETATM   39  H18 UNL     1       3.936  -1.280  -1.269  1.00  0.00           H  
HETATM   40  H19 UNL     1       6.093   0.174  -1.456  1.00  0.00           H  
HETATM   41  H20 UNL     1       6.479  -0.873   0.811  1.00  0.00           H  
HETATM   42  H21 UNL     1       6.182   2.343  -0.173  1.00  0.00           H  
HETATM   43  H22 UNL     1       5.869   1.351   1.345  1.00  0.00           H  
HETATM   44  H23 UNL     1       8.194   1.762   0.607  1.00  0.00           H  
HETATM   45  H24 UNL     1      -7.772   0.815   0.515  1.00  0.00           H  
CONECT    1    2   22   23
CONECT    2    3   19   24
CONECT    3    4   25   26
CONECT    4    5   27   28
CONECT    5    6   29   30
CONECT    6    7   31   32
CONECT    7    8   33
CONECT    8    9   34   35
CONECT    9   10   10   11
CONECT   11   12   13   36
CONECT   12   37
CONECT   13   14   15   38
CONECT   14   39
CONECT   15   16   17   40
CONECT   16   41
CONECT   17   18   42   43
CONECT   18   44
CONECT   19   20   20   21
CONECT   21   45
END

HMDB0242138
     RDKit          3D
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid
 45 44  0  0  0  0  0  0  0  0999 V2000
   -5.7789   -1.6765    1.2057 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6640   -1.4392   -0.2089 C   0  0  2  0  0  0  0  0  0  0  0  0
   -4.3788   -0.6922   -0.5549 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1678   -1.4717   -0.1305 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8826   -0.7837   -0.4526 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7252    0.5608    0.2013 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4818    1.1913   -0.1332 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.6794    0.5423    0.4128 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9059    1.2634    0.0252 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8027    2.2641   -0.6632 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2720    0.8505    0.4195 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.1717   -0.3019    1.1959 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.1276    0.6055   -0.7909 C   0  0  2  0  0  0  0  0  0  0  0  0
    3.5858   -0.4099   -1.5744 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5429    0.2725   -0.4782 C   0  0  2  0  0  0  0  0  0  0  0  0
    5.6938   -0.9189    0.2172 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.2591    1.3561    0.2887 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6053    1.0058    0.3785 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7908   -0.6115   -0.6827 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9248   -0.2690   -1.8826 O   0  0  0  0  0  0  0  0  0  0  0  0
   -7.7841   -0.1589    0.1963 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3383   -0.8908    1.7386 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8078   -1.6153    1.4372 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6486   -2.3973   -0.7564 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3761   -0.5756   -1.6606 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3880    0.3133   -0.1259 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1632   -2.4780   -0.6065 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2485   -1.6740    0.9659 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0179   -1.4194   -0.1468 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7752   -0.6670   -1.5556 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5775    1.2122   -0.0739 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7796    0.4687    1.3191 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5105    2.1831    0.1721 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7751   -0.4991    0.0446 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6204    0.5285    1.5228 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6946    1.6329    1.0816 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4082   -1.1165    0.6963 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0846    1.5227   -1.4217 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9360   -1.2799   -1.2694 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.0926    0.1740   -1.4556 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4792   -0.8733    0.8113 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.1817    2.3429   -0.1729 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.8693    1.3514    1.3448 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.1943    1.7622    0.6070 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.7719    0.8152    0.5151 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  9 10  2  0
  9 11  1  0
 11 12  1  0
 11 13  1  0
 13 14  1  0
 13 15  1  0
 15 16  1  0
 15 17  1  0
 17 18  1  0
  2 19  1  0
 19 20  2  0
 19 21  1  0
  1 22  1  0
  1 23  1  0
  2 24  1  6
  3 25  1  0
  3 26  1  0
  4 27  1  0
  4 28  1  0
  5 29  1  0
  5 30  1  0
  6 31  1  0
  6 32  1  0
  7 33  1  0
  8 34  1  0
  8 35  1  0
 11 36  1  1
 12 37  1  0
 13 38  1  6
 14 39  1  0
 15 40  1  6
 16 41  1  0
 17 42  1  0
 17 43  1  0
 18 44  1  0
 21 45  1  0
M  END

View in JSmol View NMR Assignments View Stereo Labels

Synonyms

Value	Source
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoate	Generator
Fructose lysine	HMDB
Fructoselysine	HMDB
Fructosyl-lysine	HMDB
Fructosyllysine	HMDB

Chemical Formula

C₁₂H₂₄N₂O₇

Average Molecular Weight

308.331

Monoisotopic Molecular Weight

308.158351121

IUPAC Name

(2R)-2-amino-6-{[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino}hexanoic acid

Traditional Name

(2R)-2-amino-6-{[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino}hexanoic acid

CAS Registry Number

Not Available

SMILES

[H][C@@](N)(CCCCNCC(=O)[C@@]([H])(O)[C@]([H])(O)[C@]([H])(O)CO)C(O)=O

InChI Identifier

InChI=1S/C12H24N2O7/c13-7(12(20)21)3-1-2-4-14-5-8(16)10(18)11(19)9(17)6-15/h7,9-11,14-15,17-19H,1-6,13H2,(H,20,21)/t7-,9-,10-,11-/m1/s1

InChI Key

BFSYFTQDGRDJNV-QCNRFFRDSA-N

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as d-alpha-amino acids. These are alpha amino acids which have the D-configuration of the alpha-carbon atom.

Kingdom

Organic compounds

Super Class

Organic acids and derivatives

Class

Carboxylic acids and derivatives

Sub Class

Amino acids, peptides, and analogues

Direct Parent

D-alpha-amino acids

Alternative Parents

Substituents

D-alpha-amino acid
Medium-chain fatty acid
Hydroxy fatty acid
Amino fatty acid
Fatty acyl
Fatty acid
Monosaccharide
Beta-hydroxy ketone
Acyloin
Alpha-hydroxy ketone
Alpha-aminoketone
1,3-aminoalcohol
Amino acid
Secondary alcohol
Ketone
Secondary amine
Polyol
Monocarboxylic acid or derivatives
Secondary aliphatic amine
Carboxylic acid
Organic nitrogen compound
Organic oxygen compound
Organopnictogen compound
Organic oxide
Hydrocarbon derivative
Primary amine
Primary alcohol
Organooxygen compound
Organonitrogen compound
Primary aliphatic amine
Carbonyl group
Amine
Alcohol
Aliphatic acyclic compound

Molecular Framework

Aliphatic acyclic compounds

External Descriptors

Not Available

Ontology

Not Available

Not Available

Not Available

Not Available

Physical Properties

State

Not Available

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	Not Available	Not Available

Experimental Chromatographic Properties

Not Available

Predicted Molecular Properties

Property	Value	Source
logP	-2.9	ALOGPS
logP	-5.5	ChemAxon
logS	-0.91	ALOGPS
pKa (Strongest Acidic)	2.24	ChemAxon
pKa (Strongest Basic)	9.32	ChemAxon
Physiological Charge	1	ChemAxon
Hydrogen Acceptor Count	9	ChemAxon
Hydrogen Donor Count	7	ChemAxon
Polar Surface Area	173.34 Å²	ChemAxon
Rotatable Bond Count	12	ChemAxon
Refractivity	71.88 m³·mol⁻¹	ChemAxon
Polarizability	31.24 Å³	ChemAxon
Number of Rings	0	ChemAxon
Bioavailability	No	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]+	175.957	30932474
DeepCCS	[M-H]-	172.979	30932474
DeepCCS	[M-2H]-	206.975	30932474
DeepCCS	[M+Na]+	183.274	30932474

Predicted Kovats Retention Indices

Underivatized

Metabolite	SMILES	Kovats RI Value	Column Type	Reference
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid	[H][C@@](N)(CCCCNCC(=O)[C@@]([H])(O)[C@]([H])(O)[C@]([H])(O)CO)C(O)=O	3693.7	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid	[H][C@@](N)(CCCCNCC(=O)[C@@]([H])(O)[C@]([H])(O)[C@]([H])(O)CO)C(O)=O	2699.1	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid	[H][C@@](N)(CCCCNCC(=O)[C@@]([H])(O)[C@]([H])(O)[C@]([H])(O)CO)C(O)=O	2780.0	Semi standard non polar	33892256

Derivatized

Derivative Name / Structure	SMILES	Kovats RI Value	Column Type	Reference
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #1	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)C(O[Si](C)(C)C)=C(CNCCCC[C@@H](N)C(=O)O[Si](C)(C)C)O[Si](C)(C)C	2692.0	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #1	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)C(O[Si](C)(C)C)=C(CNCCCC[C@@H](N)C(=O)O[Si](C)(C)C)O[Si](C)(C)C	2697.2	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #1	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)C(O[Si](C)(C)C)=C(CNCCCC[C@@H](N)C(=O)O[Si](C)(C)C)O[Si](C)(C)C	3638.2	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #10	C[Si](C)(C)N[C@H](CCCCN(CC(=O)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	2796.6	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #10	C[Si](C)(C)N[C@H](CCCCN(CC(=O)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	2810.7	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #10	C[Si](C)(C)N[C@H](CCCCN(CC(=O)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	3082.4	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #100	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O)[C@H](O)C(=CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3045.5	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #100	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O)[C@H](O)C(=CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2806.2	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #100	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O)[C@H](O)C(=CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3534.7	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #101	C[Si](C)(C)OC(=O)[C@@H](CCCCN(CC(O[Si](C)(C)C)=C(O)[C@H](O)[C@@H](CO)O[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3046.3	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #101	C[Si](C)(C)OC(=O)[C@@H](CCCCN(CC(O[Si](C)(C)C)=C(O)[C@H](O)[C@@H](CO)O[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2883.8	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #101	C[Si](C)(C)OC(=O)[C@@H](CCCCN(CC(O[Si](C)(C)C)=C(O)[C@H](O)[C@@H](CO)O[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3380.3	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #102	C[Si](C)(C)OC(=O)[C@@H](CCCCN(C=C(O[Si](C)(C)C)[C@@H](O)[C@H](O)[C@@H](CO)O[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3043.5	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #102	C[Si](C)(C)OC(=O)[C@@H](CCCCN(C=C(O[Si](C)(C)C)[C@@H](O)[C@H](O)[C@@H](CO)O[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2795.0	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #102	C[Si](C)(C)OC(=O)[C@@H](CCCCN(C=C(O[Si](C)(C)C)[C@@H](O)[C@H](O)[C@@H](CO)O[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3456.1	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #103	C[Si](C)(C)OC[C@@H](O)[C@@H](O)C(O)=C(CN(CCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3048.2	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #103	C[Si](C)(C)OC[C@@H](O)[C@@H](O)C(O)=C(CN(CCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2885.6	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #103	C[Si](C)(C)OC[C@@H](O)[C@@H](O)C(O)=C(CN(CCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3409.4	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #104	C[Si](C)(C)OC[C@@H](O)[C@@H](O)[C@H](O)C(=CN(CCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3037.2	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #104	C[Si](C)(C)OC[C@@H](O)[C@@H](O)[C@H](O)C(=CN(CCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2797.7	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #104	C[Si](C)(C)OC[C@@H](O)[C@@H](O)[C@H](O)C(=CN(CCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3488.3	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #11	C[Si](C)(C)N[C@H](CCCCNCC(O[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)CO[Si](C)(C)C)C(=O)O[Si](C)(C)C	2749.6	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #11	C[Si](C)(C)N[C@H](CCCCNCC(O[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)CO[Si](C)(C)C)C(=O)O[Si](C)(C)C	2798.3	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #11	C[Si](C)(C)N[C@H](CCCCNCC(O[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)CO[Si](C)(C)C)C(=O)O[Si](C)(C)C	3076.7	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #12	C[Si](C)(C)OC[C@@H](O)[C@@H](O[Si](C)(C)C)C(O[Si](C)(C)C)=C(CN(CCCC[C@@H](N)C(=O)O[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2769.9	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #12	C[Si](C)(C)OC[C@@H](O)[C@@H](O[Si](C)(C)C)C(O[Si](C)(C)C)=C(CN(CCCC[C@@H](N)C(=O)O[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2731.7	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #12	C[Si](C)(C)OC[C@@H](O)[C@@H](O[Si](C)(C)C)C(O[Si](C)(C)C)=C(CN(CCCC[C@@H](N)C(=O)O[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3650.2	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #13	C[Si](C)(C)N[C@H](CCCCNC=C(O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)CO[Si](C)(C)C)C(=O)O[Si](C)(C)C	2782.8	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #13	C[Si](C)(C)N[C@H](CCCCNC=C(O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)CO[Si](C)(C)C)C(=O)O[Si](C)(C)C	2701.8	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #13	C[Si](C)(C)N[C@H](CCCCNC=C(O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)CO[Si](C)(C)C)C(=O)O[Si](C)(C)C	3155.0	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #14	C[Si](C)(C)OC[C@@H](O)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)C(=CN(CCCC[C@@H](N)C(=O)O[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2805.4	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #14	C[Si](C)(C)OC[C@@H](O)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)C(=CN(CCCC[C@@H](N)C(=O)O[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2614.1	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #14	C[Si](C)(C)OC[C@@H](O)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)C(=CN(CCCC[C@@H](N)C(=O)O[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3656.2	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #15	C[Si](C)(C)OC[C@@H](O)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)C(=O)CNCCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2851.8	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #15	C[Si](C)(C)OC[C@@H](O)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)C(=O)CNCCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2862.7	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #15	C[Si](C)(C)OC[C@@H](O)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)C(=O)CNCCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3040.8	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #16	C[Si](C)(C)N[C@H](CCCCN(CC(=O)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)CO[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	2781.5	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #16	C[Si](C)(C)N[C@H](CCCCN(CC(=O)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)CO[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	2813.7	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #16	C[Si](C)(C)N[C@H](CCCCN(CC(=O)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)CO[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	3096.2	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #17	C[Si](C)(C)OC(=O)[C@@H](CCCCNCC(O[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)CO)N([Si](C)(C)C)[Si](C)(C)C	2899.6	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #17	C[Si](C)(C)OC(=O)[C@@H](CCCCNCC(O[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)CO)N([Si](C)(C)C)[Si](C)(C)C	2821.3	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #17	C[Si](C)(C)OC(=O)[C@@H](CCCCNCC(O[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)CO)N([Si](C)(C)C)[Si](C)(C)C	3187.2	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #18	C[Si](C)(C)N[C@H](CCCCN(CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)CO)[Si](C)(C)C)C(=O)O[Si](C)(C)C	2842.5	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #18	C[Si](C)(C)N[C@H](CCCCN(CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)CO)[Si](C)(C)C)C(=O)O[Si](C)(C)C	2795.2	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #18	C[Si](C)(C)N[C@H](CCCCN(CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)CO)[Si](C)(C)C)C(=O)O[Si](C)(C)C	3244.1	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #19	C[Si](C)(C)OC(=O)[C@@H](CCCCNC=C(O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)CO)N([Si](C)(C)C)[Si](C)(C)C	2911.9	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #19	C[Si](C)(C)OC(=O)[C@@H](CCCCNC=C(O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)CO)N([Si](C)(C)C)[Si](C)(C)C	2759.6	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #19	C[Si](C)(C)OC(=O)[C@@H](CCCCNC=C(O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)CO)N([Si](C)(C)C)[Si](C)(C)C	3258.3	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #2	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)C(=CNCCCC[C@@H](N)C(=O)O[Si](C)(C)C)O[Si](C)(C)C	2744.6	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #2	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)C(=CNCCCC[C@@H](N)C(=O)O[Si](C)(C)C)O[Si](C)(C)C	2602.6	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #2	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)C(=CNCCCC[C@@H](N)C(=O)O[Si](C)(C)C)O[Si](C)(C)C	3640.3	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #20	C[Si](C)(C)N[C@H](CCCCN(C=C(O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)CO)[Si](C)(C)C)C(=O)O[Si](C)(C)C	2850.6	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #20	C[Si](C)(C)N[C@H](CCCCN(C=C(O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)CO)[Si](C)(C)C)C(=O)O[Si](C)(C)C	2683.1	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #20	C[Si](C)(C)N[C@H](CCCCN(C=C(O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)CO)[Si](C)(C)C)C(=O)O[Si](C)(C)C	3314.4	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #21	C[Si](C)(C)OC(=O)[C@@H](CCCCN(CC(=O)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)CO)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2937.4	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #21	C[Si](C)(C)OC(=O)[C@@H](CCCCN(CC(=O)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)CO)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2869.6	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #21	C[Si](C)(C)OC(=O)[C@@H](CCCCN(CC(=O)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)CO)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3196.5	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #22	C[Si](C)(C)N[C@H](CCCCNCC(O[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)C(=O)O[Si](C)(C)C	2743.5	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #22	C[Si](C)(C)N[C@H](CCCCNCC(O[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)C(=O)O[Si](C)(C)C	2803.0	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #22	C[Si](C)(C)N[C@H](CCCCNCC(O[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)C(=O)O[Si](C)(C)C	3101.9	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #23	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O)C(O[Si](C)(C)C)=C(CN(CCCC[C@@H](N)C(=O)O[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2762.7	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #23	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O)C(O[Si](C)(C)C)=C(CN(CCCC[C@@H](N)C(=O)O[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2739.4	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #23	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O)C(O[Si](C)(C)C)=C(CN(CCCC[C@@H](N)C(=O)O[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3674.2	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #24	C[Si](C)(C)N[C@H](CCCCNC=C(O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)C(=O)O[Si](C)(C)C	2801.8	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #24	C[Si](C)(C)N[C@H](CCCCNC=C(O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)C(=O)O[Si](C)(C)C	2708.2	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #24	C[Si](C)(C)N[C@H](CCCCNC=C(O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)C(=O)O[Si](C)(C)C	3181.5	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #25	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)C(=CN(CCCC[C@@H](N)C(=O)O[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2818.6	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #25	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)C(=CN(CCCC[C@@H](N)C(=O)O[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2622.6	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #25	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)C(=CN(CCCC[C@@H](N)C(=O)O[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3683.7	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #26	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)C(=O)CNCCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2858.7	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #26	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)C(=O)CNCCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2863.0	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #26	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)C(=O)CNCCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3064.5	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #27	C[Si](C)(C)N[C@H](CCCCN(CC(=O)[C@@H](O[Si](C)(C)C)[C@H](O)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	2794.3	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #27	C[Si](C)(C)N[C@H](CCCCN(CC(=O)[C@@H](O[Si](C)(C)C)[C@H](O)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	2814.8	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #27	C[Si](C)(C)N[C@H](CCCCN(CC(=O)[C@@H](O[Si](C)(C)C)[C@H](O)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	3120.1	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #28	C[Si](C)(C)OC(=O)[C@@H](CCCCNCC(O[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O)[C@@H](CO)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2911.1	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #28	C[Si](C)(C)OC(=O)[C@@H](CCCCNCC(O[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O)[C@@H](CO)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2833.2	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #28	C[Si](C)(C)OC(=O)[C@@H](CCCCNCC(O[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O)[C@@H](CO)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3166.9	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #29	C[Si](C)(C)N[C@H](CCCCN(CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O)[C@@H](CO)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	2844.5	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #29	C[Si](C)(C)N[C@H](CCCCN(CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O)[C@@H](CO)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	2804.6	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #29	C[Si](C)(C)N[C@H](CCCCN(CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O)[C@@H](CO)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	3222.9	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #3	C[Si](C)(C)N[C@H](CCCCNCC(=O)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)C(=O)O[Si](C)(C)C	2739.3	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #3	C[Si](C)(C)N[C@H](CCCCNCC(=O)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)C(=O)O[Si](C)(C)C	2794.8	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #3	C[Si](C)(C)N[C@H](CCCCNCC(=O)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)C(=O)O[Si](C)(C)C	2985.0	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #30	C[Si](C)(C)OC(=O)[C@@H](CCCCNC=C(O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)[C@@H](CO)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2936.2	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #30	C[Si](C)(C)OC(=O)[C@@H](CCCCNC=C(O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)[C@@H](CO)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2773.2	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #30	C[Si](C)(C)OC(=O)[C@@H](CCCCNC=C(O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)[C@@H](CO)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3242.6	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #31	C[Si](C)(C)N[C@H](CCCCN(C=C(O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)[C@@H](CO)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	2864.5	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #31	C[Si](C)(C)N[C@H](CCCCN(C=C(O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)[C@@H](CO)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	2693.6	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #31	C[Si](C)(C)N[C@H](CCCCN(C=C(O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)[C@@H](CO)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	3299.9	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #32	C[Si](C)(C)OC(=O)[C@@H](CCCCN(CC(=O)[C@@H](O[Si](C)(C)C)[C@H](O)[C@@H](CO)O[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2978.7	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #32	C[Si](C)(C)OC(=O)[C@@H](CCCCN(CC(=O)[C@@H](O[Si](C)(C)C)[C@H](O)[C@@H](CO)O[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2874.7	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #32	C[Si](C)(C)OC(=O)[C@@H](CCCCN(CC(=O)[C@@H](O[Si](C)(C)C)[C@H](O)[C@@H](CO)O[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3174.5	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #33	C[Si](C)(C)OC[C@@H](O)[C@@H](O)C(O[Si](C)(C)C)=C(CNCCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2909.1	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #33	C[Si](C)(C)OC[C@@H](O)[C@@H](O)C(O[Si](C)(C)C)=C(CNCCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2838.7	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #33	C[Si](C)(C)OC[C@@H](O)[C@@H](O)C(O[Si](C)(C)C)=C(CNCCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3214.0	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #34	C[Si](C)(C)N[C@H](CCCCN(CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O)[C@H](O)CO[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	2843.1	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #34	C[Si](C)(C)N[C@H](CCCCN(CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O)[C@H](O)CO[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	2812.1	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #34	C[Si](C)(C)N[C@H](CCCCN(CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O)[C@H](O)CO[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	3271.6	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #35	C[Si](C)(C)OC[C@@H](O)[C@@H](O)[C@H](O[Si](C)(C)C)C(=CNCCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2925.5	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #35	C[Si](C)(C)OC[C@@H](O)[C@@H](O)[C@H](O[Si](C)(C)C)C(=CNCCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2779.2	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #35	C[Si](C)(C)OC[C@@H](O)[C@@H](O)[C@H](O[Si](C)(C)C)C(=CNCCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3287.7	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #36	C[Si](C)(C)N[C@H](CCCCN(C=C(O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H](O)CO[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	2860.8	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #36	C[Si](C)(C)N[C@H](CCCCN(C=C(O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H](O)CO[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	2696.1	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #36	C[Si](C)(C)N[C@H](CCCCN(C=C(O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H](O)CO[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	3343.4	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #37	C[Si](C)(C)OC[C@@H](O)[C@@H](O)[C@H](O[Si](C)(C)C)C(=O)CN(CCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	2973.1	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #37	C[Si](C)(C)OC[C@@H](O)[C@@H](O)[C@H](O[Si](C)(C)C)C(=O)CN(CCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	2876.0	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #37	C[Si](C)(C)OC[C@@H](O)[C@@H](O)[C@H](O[Si](C)(C)C)C(=O)CN(CCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3222.1	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #38	C[Si](C)(C)OC(=O)[C@@H](CCCCN(CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O)[C@H](O)CO)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3023.5	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #38	C[Si](C)(C)OC(=O)[C@@H](CCCCN(CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O)[C@H](O)CO)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2827.5	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #38	C[Si](C)(C)OC(=O)[C@@H](CCCCN(CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O)[C@H](O)CO)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3370.1	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #39	C[Si](C)(C)OC(=O)[C@@H](CCCCN(C=C(O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H](O)CO)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3005.1	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #39	C[Si](C)(C)OC(=O)[C@@H](CCCCN(C=C(O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H](O)CO)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2749.7	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #39	C[Si](C)(C)OC(=O)[C@@H](CCCCN(C=C(O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H](O)CO)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3438.0	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #4	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)C(=O)CN(CCCC[C@@H](N)C(=O)O[Si](C)(C)C)[Si](C)(C)C	2716.2	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #4	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)C(=O)CN(CCCC[C@@H](N)C(=O)O[Si](C)(C)C)[Si](C)(C)C	2730.2	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #4	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)C(=O)CN(CCCC[C@@H](N)C(=O)O[Si](C)(C)C)[Si](C)(C)C	3659.7	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #40	C[Si](C)(C)N[C@H](CCCCNCC(O[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)C(=O)O	2829.6	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #40	C[Si](C)(C)N[C@H](CCCCNCC(O[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)C(=O)O	2773.7	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #40	C[Si](C)(C)N[C@H](CCCCNCC(O[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)C(=O)O	3178.7	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #41	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)C(O[Si](C)(C)C)=C(CN(CCCC[C@@H](N)C(=O)O)[Si](C)(C)C)O[Si](C)(C)C	2801.0	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #41	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)C(O[Si](C)(C)C)=C(CN(CCCC[C@@H](N)C(=O)O)[Si](C)(C)C)O[Si](C)(C)C	2710.9	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #41	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)C(O[Si](C)(C)C)=C(CN(CCCC[C@@H](N)C(=O)O)[Si](C)(C)C)O[Si](C)(C)C	3827.5	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #42	C[Si](C)(C)N[C@H](CCCCNC=C(O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)C(=O)O	2865.2	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #42	C[Si](C)(C)N[C@H](CCCCNC=C(O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)C(=O)O	2681.6	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #42	C[Si](C)(C)N[C@H](CCCCNC=C(O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)C(=O)O	3256.8	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #43	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)C(=CN(CCCC[C@@H](N)C(=O)O)[Si](C)(C)C)O[Si](C)(C)C	2861.8	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #43	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)C(=CN(CCCC[C@@H](N)C(=O)O)[Si](C)(C)C)O[Si](C)(C)C	2594.8	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #43	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)C(=CN(CCCC[C@@H](N)C(=O)O)[Si](C)(C)C)O[Si](C)(C)C	3823.3	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #44	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)C(=O)CNCCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C	2880.6	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #44	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)C(=O)CNCCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C	2851.7	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #44	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)C(=O)CNCCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C	3113.5	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #45	C[Si](C)(C)N[C@H](CCCCN(CC(=O)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O	2837.4	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #45	C[Si](C)(C)N[C@H](CCCCN(CC(=O)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O	2786.2	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #45	C[Si](C)(C)N[C@H](CCCCN(CC(=O)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O	3198.1	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #46	C[Si](C)(C)OC(CNCCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C	2923.5	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #46	C[Si](C)(C)OC(CNCCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C	2822.9	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #46	C[Si](C)(C)OC(CNCCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C	3213.1	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #47	C[Si](C)(C)N[C@H](CCCCN(CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O	2900.0	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #47	C[Si](C)(C)N[C@H](CCCCN(CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O	2784.5	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #47	C[Si](C)(C)N[C@H](CCCCN(CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O	3296.0	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #48	C[Si](C)(C)OC(=CNCCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C	2952.0	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #48	C[Si](C)(C)OC(=CNCCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C	2767.2	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #48	C[Si](C)(C)OC(=CNCCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C	3289.5	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #49	C[Si](C)(C)N[C@H](CCCCN(C=C(O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O	2921.6	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #49	C[Si](C)(C)N[C@H](CCCCN(C=C(O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O	2675.2	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #49	C[Si](C)(C)N[C@H](CCCCN(C=C(O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O	3368.3	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #5	C[Si](C)(C)N[C@H](CCCCNCC(O[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C)C(=O)O[Si](C)(C)C	2762.1	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #5	C[Si](C)(C)N[C@H](CCCCNCC(O[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C)C(=O)O[Si](C)(C)C	2798.6	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #5	C[Si](C)(C)N[C@H](CCCCNCC(O[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C)C(=O)O[Si](C)(C)C	3063.8	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #50	C[Si](C)(C)O[C@H](C(=O)CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C	2960.1	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #50	C[Si](C)(C)O[C@H](C(=O)CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C	2863.5	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #50	C[Si](C)(C)O[C@H](C(=O)CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C	3224.7	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #51	C[Si](C)(C)OC[C@@H](O)[C@@H](O[Si](C)(C)C)C(O[Si](C)(C)C)=C(CNCCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2915.2	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #51	C[Si](C)(C)OC[C@@H](O)[C@@H](O[Si](C)(C)C)C(O[Si](C)(C)C)=C(CNCCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2825.0	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #51	C[Si](C)(C)OC[C@@H](O)[C@@H](O[Si](C)(C)C)C(O[Si](C)(C)C)=C(CNCCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3225.4	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #52	C[Si](C)(C)N[C@H](CCCCN(CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)CO[Si](C)(C)C)[Si](C)(C)C)C(=O)O	2890.9	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #52	C[Si](C)(C)N[C@H](CCCCN(CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)CO[Si](C)(C)C)[Si](C)(C)C)C(=O)O	2786.3	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #52	C[Si](C)(C)N[C@H](CCCCN(CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)CO[Si](C)(C)C)[Si](C)(C)C)C(=O)O	3309.0	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #53	C[Si](C)(C)OC[C@@H](O)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)C(=CNCCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2941.1	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #53	C[Si](C)(C)OC[C@@H](O)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)C(=CNCCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2778.1	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #53	C[Si](C)(C)OC[C@@H](O)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)C(=CNCCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3304.5	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #54	C[Si](C)(C)N[C@H](CCCCN(C=C(O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)CO[Si](C)(C)C)[Si](C)(C)C)C(=O)O	2911.6	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #54	C[Si](C)(C)N[C@H](CCCCN(C=C(O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)CO[Si](C)(C)C)[Si](C)(C)C)C(=O)O	2689.2	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #54	C[Si](C)(C)N[C@H](CCCCN(C=C(O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)CO[Si](C)(C)C)[Si](C)(C)C)C(=O)O	3381.6	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #55	C[Si](C)(C)OC[C@@H](O)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)C(=O)CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	2958.1	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #55	C[Si](C)(C)OC[C@@H](O)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)C(=O)CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	2866.7	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #55	C[Si](C)(C)OC[C@@H](O)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)C(=O)CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3236.6	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #56	C[Si](C)(C)OC(CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)CO	3025.6	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #56	C[Si](C)(C)OC(CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)CO	2828.0	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #56	C[Si](C)(C)OC(CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)CO	3386.7	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #57	C[Si](C)(C)OC(=CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)CO	3014.3	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #57	C[Si](C)(C)OC(=CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)CO	2758.5	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #57	C[Si](C)(C)OC(=CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)CO	3455.6	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #58	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O)C(O[Si](C)(C)C)=C(CNCCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2908.6	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #58	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O)C(O[Si](C)(C)C)=C(CNCCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2828.9	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #58	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O)C(O[Si](C)(C)C)=C(CNCCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3249.8	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #59	C[Si](C)(C)N[C@H](CCCCN(CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O	2888.4	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #59	C[Si](C)(C)N[C@H](CCCCN(CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O	2789.1	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #59	C[Si](C)(C)N[C@H](CCCCN(CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O	3333.9	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #6	C[Si](C)(C)OC(=O)[C@H](N)CCCCN(CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C)[Si](C)(C)C	2777.0	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #6	C[Si](C)(C)OC(=O)[C@H](N)CCCCN(CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C)[Si](C)(C)C	2731.6	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #6	C[Si](C)(C)OC(=O)[C@H](N)CCCCN(CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C)[Si](C)(C)C	3658.8	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #60	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)C(=CNCCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2950.3	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #60	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)C(=CNCCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2779.1	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #60	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)C(=CNCCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3330.0	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #61	C[Si](C)(C)N[C@H](CCCCN(C=C(O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O	2921.0	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #61	C[Si](C)(C)N[C@H](CCCCN(C=C(O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O	2692.2	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #61	C[Si](C)(C)N[C@H](CCCCN(C=C(O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O	3408.8	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #62	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)C(=O)CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	2963.3	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #62	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)C(=O)CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	2868.0	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #62	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)C(=O)CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3260.6	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #63	C[Si](C)(C)OC(CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O)[C@@H](CO)O[Si](C)(C)C	3034.9	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #63	C[Si](C)(C)OC(CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O)[C@@H](CO)O[Si](C)(C)C	2839.4	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #63	C[Si](C)(C)OC(CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O)[C@@H](CO)O[Si](C)(C)C	3365.7	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #64	C[Si](C)(C)OC(=CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)[C@@H](CO)O[Si](C)(C)C	3039.4	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #64	C[Si](C)(C)OC(=CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)[C@@H](CO)O[Si](C)(C)C	2769.6	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #64	C[Si](C)(C)OC(=CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)[C@@H](CO)O[Si](C)(C)C	3439.5	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #65	C[Si](C)(C)OC[C@@H](O)[C@@H](O)C(O[Si](C)(C)C)=C(CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3048.0	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #65	C[Si](C)(C)OC[C@@H](O)[C@@H](O)C(O[Si](C)(C)C)=C(CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2849.9	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #65	C[Si](C)(C)OC[C@@H](O)[C@@H](O)C(O[Si](C)(C)C)=C(CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3412.5	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #66	C[Si](C)(C)OC[C@@H](O)[C@@H](O)[C@H](O[Si](C)(C)C)C(=CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3036.9	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #66	C[Si](C)(C)OC[C@@H](O)[C@@H](O)[C@H](O[Si](C)(C)C)C(=CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2776.9	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #66	C[Si](C)(C)OC[C@@H](O)[C@@H](O)[C@H](O[Si](C)(C)C)C(=CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3483.8	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #67	C[Si](C)(C)N[C@H](CCCCNCC(O[Si](C)(C)C)=C(O)[C@H](O[Si](C)(C)C)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)C(=O)O[Si](C)(C)C	2753.9	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #67	C[Si](C)(C)N[C@H](CCCCNCC(O[Si](C)(C)C)=C(O)[C@H](O[Si](C)(C)C)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)C(=O)O[Si](C)(C)C	2811.3	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #67	C[Si](C)(C)N[C@H](CCCCNCC(O[Si](C)(C)C)=C(O)[C@H](O[Si](C)(C)C)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)C(=O)O[Si](C)(C)C	3131.9	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #68	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)C(O)=C(CN(CCCC[C@@H](N)C(=O)O[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2781.8	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #68	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)C(O)=C(CN(CCCC[C@@H](N)C(=O)O[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2732.4	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #68	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)C(O)=C(CN(CCCC[C@@H](N)C(=O)O[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3702.4	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #69	C[Si](C)(C)N[C@H](CCCCNC=C(O[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)C(=O)O[Si](C)(C)C	2796.4	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #69	C[Si](C)(C)N[C@H](CCCCNC=C(O[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)C(=O)O[Si](C)(C)C	2730.4	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #69	C[Si](C)(C)N[C@H](CCCCNC=C(O[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)C(=O)O[Si](C)(C)C	3228.3	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #7	C[Si](C)(C)N[C@H](CCCCNC=C(O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C)C(=O)O[Si](C)(C)C	2805.8	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #7	C[Si](C)(C)N[C@H](CCCCNC=C(O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C)C(=O)O[Si](C)(C)C	2691.5	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #7	C[Si](C)(C)N[C@H](CCCCNC=C(O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C)C(=O)O[Si](C)(C)C	3139.7	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #70	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)C(=CN(CCCC[C@@H](N)C(=O)O[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2823.9	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #70	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)C(=CN(CCCC[C@@H](N)C(=O)O[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2644.1	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #70	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)C(=CN(CCCC[C@@H](N)C(=O)O[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3726.1	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #71	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)C(=O)CNCCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2857.7	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #71	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)C(=O)CNCCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2874.4	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #71	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)C(=O)CNCCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3084.1	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #72	C[Si](C)(C)N[C@H](CCCCN(CC(=O)[C@@H](O)[C@H](O[Si](C)(C)C)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	2801.6	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #72	C[Si](C)(C)N[C@H](CCCCN(CC(=O)[C@@H](O)[C@H](O[Si](C)(C)C)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	2814.0	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #72	C[Si](C)(C)N[C@H](CCCCN(CC(=O)[C@@H](O)[C@H](O[Si](C)(C)C)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	3135.6	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #73	C[Si](C)(C)OC(=O)[C@@H](CCCCNCC(O[Si](C)(C)C)=C(O)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2906.2	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #73	C[Si](C)(C)OC(=O)[C@@H](CCCCNCC(O[Si](C)(C)C)=C(O)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2864.8	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #73	C[Si](C)(C)OC(=O)[C@@H](CCCCNCC(O[Si](C)(C)C)=C(O)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3200.1	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #74	C[Si](C)(C)N[C@H](CCCCN(CC(O[Si](C)(C)C)=C(O)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	2850.0	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #74	C[Si](C)(C)N[C@H](CCCCN(CC(O[Si](C)(C)C)=C(O)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	2813.0	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #74	C[Si](C)(C)N[C@H](CCCCN(CC(O[Si](C)(C)C)=C(O)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	3250.0	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #75	C[Si](C)(C)OC(=O)[C@@H](CCCCNC=C(O[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2938.0	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #75	C[Si](C)(C)OC(=O)[C@@H](CCCCNC=C(O[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2797.7	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #75	C[Si](C)(C)OC(=O)[C@@H](CCCCNC=C(O[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3290.4	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #76	C[Si](C)(C)N[C@H](CCCCN(C=C(O[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	2870.7	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #76	C[Si](C)(C)N[C@H](CCCCN(C=C(O[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	2718.1	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #76	C[Si](C)(C)N[C@H](CCCCN(C=C(O[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	3335.3	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #77	C[Si](C)(C)OC(=O)[C@@H](CCCCN(CC(=O)[C@@H](O)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2968.3	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #77	C[Si](C)(C)OC(=O)[C@@H](CCCCN(CC(=O)[C@@H](O)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2869.8	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #77	C[Si](C)(C)OC(=O)[C@@H](CCCCN(CC(=O)[C@@H](O)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3194.4	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #78	C[Si](C)(C)OC[C@@H](O)[C@@H](O[Si](C)(C)C)C(O)=C(CNCCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2905.0	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #78	C[Si](C)(C)OC[C@@H](O)[C@@H](O[Si](C)(C)C)C(O)=C(CNCCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2869.8	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #78	C[Si](C)(C)OC[C@@H](O)[C@@H](O[Si](C)(C)C)C(O)=C(CNCCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3205.3	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #79	C[Si](C)(C)N[C@H](CCCCN(CC(O[Si](C)(C)C)=C(O)[C@H](O[Si](C)(C)C)[C@H](O)CO[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	2846.7	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #79	C[Si](C)(C)N[C@H](CCCCN(CC(O[Si](C)(C)C)=C(O)[C@H](O[Si](C)(C)C)[C@H](O)CO[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	2818.9	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #79	C[Si](C)(C)N[C@H](CCCCN(CC(O[Si](C)(C)C)=C(O)[C@H](O[Si](C)(C)C)[C@H](O)CO[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	3255.5	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #8	C[Si](C)(C)OC(=O)[C@H](N)CCCCN(C=C(O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C)[Si](C)(C)C	2816.1	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #8	C[Si](C)(C)OC(=O)[C@H](N)CCCCN(C=C(O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C)[Si](C)(C)C	2602.0	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #8	C[Si](C)(C)OC(=O)[C@H](N)CCCCN(C=C(O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C)[Si](C)(C)C	3662.4	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #80	C[Si](C)(C)OC[C@@H](O)[C@@H](O[Si](C)(C)C)[C@H](O)C(=CNCCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2932.4	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #80	C[Si](C)(C)OC[C@@H](O)[C@@H](O[Si](C)(C)C)[C@H](O)C(=CNCCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2806.3	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #80	C[Si](C)(C)OC[C@@H](O)[C@@H](O[Si](C)(C)C)[C@H](O)C(=CNCCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3299.1	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #81	C[Si](C)(C)N[C@H](CCCCN(C=C(O[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H](O)CO[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	2862.2	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #81	C[Si](C)(C)N[C@H](CCCCN(C=C(O[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H](O)CO[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	2728.0	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #81	C[Si](C)(C)N[C@H](CCCCN(C=C(O[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H](O)CO[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	3343.8	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #82	C[Si](C)(C)OC[C@@H](O)[C@@H](O[Si](C)(C)C)[C@H](O)C(=O)CN(CCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	2980.3	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #82	C[Si](C)(C)OC[C@@H](O)[C@@H](O[Si](C)(C)C)[C@H](O)C(=O)CN(CCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	2874.3	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #82	C[Si](C)(C)OC[C@@H](O)[C@@H](O[Si](C)(C)C)[C@H](O)C(=O)CN(CCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3197.9	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #83	C[Si](C)(C)OC(=O)[C@@H](CCCCN(CC(O[Si](C)(C)C)=C(O)[C@H](O[Si](C)(C)C)[C@H](O)CO)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3021.6	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #83	C[Si](C)(C)OC(=O)[C@@H](CCCCN(CC(O[Si](C)(C)C)=C(O)[C@H](O[Si](C)(C)C)[C@H](O)CO)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2870.7	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #83	C[Si](C)(C)OC(=O)[C@@H](CCCCN(CC(O[Si](C)(C)C)=C(O)[C@H](O[Si](C)(C)C)[C@H](O)CO)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3365.8	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #84	C[Si](C)(C)OC(=O)[C@@H](CCCCN(C=C(O[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H](O)CO)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3021.6	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #84	C[Si](C)(C)OC(=O)[C@@H](CCCCN(C=C(O[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H](O)CO)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2781.4	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #84	C[Si](C)(C)OC(=O)[C@@H](CCCCN(C=C(O[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H](O)CO)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3446.5	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #85	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)C(O)=C(CNCCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2922.1	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #85	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)C(O)=C(CNCCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2862.5	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #85	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)C(O)=C(CNCCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3281.5	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #86	C[Si](C)(C)N[C@H](CCCCN(CC(O[Si](C)(C)C)=C(O)[C@H](O[Si](C)(C)C)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O	2902.4	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #86	C[Si](C)(C)N[C@H](CCCCN(CC(O[Si](C)(C)C)=C(O)[C@H](O[Si](C)(C)C)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O	2798.6	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #86	C[Si](C)(C)N[C@H](CCCCN(CC(O[Si](C)(C)C)=C(O)[C@H](O[Si](C)(C)C)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O	3358.1	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #87	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)C(=CNCCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2948.4	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #87	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)C(=CNCCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2799.1	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #87	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)C(=CNCCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3374.2	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #88	C[Si](C)(C)N[C@H](CCCCN(C=C(O[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O	2929.2	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #88	C[Si](C)(C)N[C@H](CCCCN(C=C(O[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O	2711.1	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #88	C[Si](C)(C)N[C@H](CCCCN(C=C(O[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O	3442.4	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #89	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)C(=O)CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	2963.3	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #89	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)C(=O)CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	2864.4	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #89	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)C(=O)CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3275.7	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #9	C[Si](C)(C)OC(=O)[C@@H](CCCCNCC(=O)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2870.2	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #9	C[Si](C)(C)OC(=O)[C@@H](CCCCNCC(=O)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2859.8	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #9	C[Si](C)(C)OC(=O)[C@@H](CCCCNCC(=O)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3025.6	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #90	C[Si](C)(C)OC(CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)=C(O)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C	3035.1	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #90	C[Si](C)(C)OC(CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)=C(O)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C	2875.4	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #90	C[Si](C)(C)OC(CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)=C(O)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C	3391.1	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #91	C[Si](C)(C)OC(=CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C	3039.4	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #91	C[Si](C)(C)OC(=CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C	2792.1	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #91	C[Si](C)(C)OC(=CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C	3472.6	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #92	C[Si](C)(C)OC[C@@H](O)[C@@H](O[Si](C)(C)C)C(O)=C(CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3051.2	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #92	C[Si](C)(C)OC[C@@H](O)[C@@H](O[Si](C)(C)C)C(O)=C(CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2880.9	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #92	C[Si](C)(C)OC[C@@H](O)[C@@H](O[Si](C)(C)C)C(O)=C(CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3395.4	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #93	C[Si](C)(C)OC[C@@H](O)[C@@H](O[Si](C)(C)C)[C@H](O)C(=CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3044.4	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #93	C[Si](C)(C)OC[C@@H](O)[C@@H](O[Si](C)(C)C)[C@H](O)C(=CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2801.7	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #93	C[Si](C)(C)OC[C@@H](O)[C@@H](O[Si](C)(C)C)[C@H](O)C(=CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3480.4	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #94	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O)C(O)=C(CNCCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2905.0	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #94	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O)C(O)=C(CNCCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2872.7	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #94	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O)C(O)=C(CNCCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3262.5	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #95	C[Si](C)(C)N[C@H](CCCCN(CC(O[Si](C)(C)C)=C(O)[C@H](O)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	2856.9	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #95	C[Si](C)(C)N[C@H](CCCCN(CC(O[Si](C)(C)C)=C(O)[C@H](O)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	2821.9	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #95	C[Si](C)(C)N[C@H](CCCCN(CC(O[Si](C)(C)C)=C(O)[C@H](O)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	3312.2	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #96	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O)[C@H](O)C(=CNCCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2939.6	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #96	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O)[C@H](O)C(=CNCCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2808.9	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #96	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O)[C@H](O)C(=CNCCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3350.0	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #97	C[Si](C)(C)N[C@H](CCCCN(C=C(O[Si](C)(C)C)[C@@H](O)[C@H](O)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	2883.1	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #97	C[Si](C)(C)N[C@H](CCCCN(C=C(O[Si](C)(C)C)[C@@H](O)[C@H](O)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	2733.6	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #97	C[Si](C)(C)N[C@H](CCCCN(C=C(O[Si](C)(C)C)[C@@H](O)[C@H](O)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	3393.6	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #98	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O)[C@H](O)C(=O)CN(CCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	2965.9	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #98	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O)[C@H](O)C(=O)CN(CCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	2878.8	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #98	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O)[C@H](O)C(=O)CN(CCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3269.8	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #99	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O)C(O)=C(CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3045.7	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #99	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O)C(O)=C(CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2881.2	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,6TMS,isomer #99	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O)C(O)=C(CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3457.2	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #1	C[Si](C)(C)N[C@H](CCCCNCC(O[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)C(=O)O[Si](C)(C)C	2779.0	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #1	C[Si](C)(C)N[C@H](CCCCNCC(O[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)C(=O)O[Si](C)(C)C	2842.2	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #1	C[Si](C)(C)N[C@H](CCCCNCC(O[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)C(=O)O[Si](C)(C)C	2963.9	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #10	C[Si](C)(C)N[C@H](CCCCN(C=C(O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	2865.3	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #10	C[Si](C)(C)N[C@H](CCCCN(C=C(O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	2730.3	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #10	C[Si](C)(C)N[C@H](CCCCN(C=C(O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	3125.2	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #11	C[Si](C)(C)OC(=O)[C@@H](CCCCN(CC(=O)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3007.1	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #11	C[Si](C)(C)OC(=O)[C@@H](CCCCN(CC(=O)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2902.4	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #11	C[Si](C)(C)OC(=O)[C@@H](CCCCN(CC(=O)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3015.7	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #12	C[Si](C)(C)OC[C@@H](O)[C@@H](O[Si](C)(C)C)C(O[Si](C)(C)C)=C(CNCCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2921.2	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #12	C[Si](C)(C)OC[C@@H](O)[C@@H](O[Si](C)(C)C)C(O[Si](C)(C)C)=C(CNCCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2872.1	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #12	C[Si](C)(C)OC[C@@H](O)[C@@H](O[Si](C)(C)C)C(O[Si](C)(C)C)=C(CNCCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3015.0	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #13	C[Si](C)(C)N[C@H](CCCCN(CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)CO[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	2839.1	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #13	C[Si](C)(C)N[C@H](CCCCN(CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)CO[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	2847.8	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #13	C[Si](C)(C)N[C@H](CCCCN(CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)CO[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	3070.2	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #14	C[Si](C)(C)OC[C@@H](O)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)C(=CNCCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2933.3	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #14	C[Si](C)(C)OC[C@@H](O)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)C(=CNCCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2815.2	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #14	C[Si](C)(C)OC[C@@H](O)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)C(=CNCCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3077.3	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #15	C[Si](C)(C)N[C@H](CCCCN(C=C(O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)CO[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	2847.8	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #15	C[Si](C)(C)N[C@H](CCCCN(C=C(O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)CO[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	2739.7	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #15	C[Si](C)(C)N[C@H](CCCCN(C=C(O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)CO[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	3144.0	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #16	C[Si](C)(C)OC[C@@H](O)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)C(=O)CN(CCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	2997.5	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #16	C[Si](C)(C)OC[C@@H](O)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)C(=O)CN(CCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	2905.7	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #16	C[Si](C)(C)OC[C@@H](O)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)C(=O)CN(CCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3030.6	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #17	C[Si](C)(C)OC(=O)[C@@H](CCCCN(CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)CO)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3043.2	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #17	C[Si](C)(C)OC(=O)[C@@H](CCCCN(CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)CO)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2868.7	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #17	C[Si](C)(C)OC(=O)[C@@H](CCCCN(CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)CO)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3163.0	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #18	C[Si](C)(C)OC(=O)[C@@H](CCCCN(C=C(O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)CO)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3020.4	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #18	C[Si](C)(C)OC(=O)[C@@H](CCCCN(C=C(O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)CO)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2789.9	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #18	C[Si](C)(C)OC(=O)[C@@H](CCCCN(C=C(O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)CO)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3233.2	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #19	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O)C(O[Si](C)(C)C)=C(CNCCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2920.0	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #19	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O)C(O[Si](C)(C)C)=C(CNCCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2876.5	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #19	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O)C(O[Si](C)(C)C)=C(CNCCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3035.2	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #2	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)C(O[Si](C)(C)C)=C(CN(CCCC[C@@H](N)C(=O)O[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2801.8	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #2	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)C(O[Si](C)(C)C)=C(CN(CCCC[C@@H](N)C(=O)O[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2768.3	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #2	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)C(O[Si](C)(C)C)=C(CN(CCCC[C@@H](N)C(=O)O[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3571.3	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #20	C[Si](C)(C)N[C@H](CCCCN(CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	2837.0	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #20	C[Si](C)(C)N[C@H](CCCCN(CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	2852.6	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #20	C[Si](C)(C)N[C@H](CCCCN(CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	3091.0	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #21	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)C(=CNCCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2950.6	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #21	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)C(=CNCCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2821.7	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #21	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)C(=CNCCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3097.9	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #22	C[Si](C)(C)N[C@H](CCCCN(C=C(O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	2857.7	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #22	C[Si](C)(C)N[C@H](CCCCN(C=C(O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	2745.3	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #22	C[Si](C)(C)N[C@H](CCCCN(C=C(O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	3165.9	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #23	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)C(=O)CN(CCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3003.7	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #23	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)C(=O)CN(CCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	2906.9	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #23	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)C(=O)CN(CCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3050.1	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #24	C[Si](C)(C)OC(=O)[C@@H](CCCCN(CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O)[C@@H](CO)O[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3059.8	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #24	C[Si](C)(C)OC(=O)[C@@H](CCCCN(CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O)[C@@H](CO)O[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2878.9	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #24	C[Si](C)(C)OC(=O)[C@@H](CCCCN(CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O)[C@@H](CO)O[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3149.2	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #25	C[Si](C)(C)OC(=O)[C@@H](CCCCN(C=C(O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)[C@@H](CO)O[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3051.0	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #25	C[Si](C)(C)OC(=O)[C@@H](CCCCN(C=C(O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)[C@@H](CO)O[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2802.3	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #25	C[Si](C)(C)OC(=O)[C@@H](CCCCN(C=C(O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)[C@@H](CO)O[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3223.1	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #26	C[Si](C)(C)OC[C@@H](O)[C@@H](O)C(O[Si](C)(C)C)=C(CN(CCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3058.4	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #26	C[Si](C)(C)OC[C@@H](O)[C@@H](O)C(O[Si](C)(C)C)=C(CN(CCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2890.3	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #26	C[Si](C)(C)OC[C@@H](O)[C@@H](O)C(O[Si](C)(C)C)=C(CN(CCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3186.7	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #27	C[Si](C)(C)OC[C@@H](O)[C@@H](O)[C@H](O[Si](C)(C)C)C(=CN(CCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3034.8	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #27	C[Si](C)(C)OC[C@@H](O)[C@@H](O)[C@H](O[Si](C)(C)C)C(=CN(CCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2803.1	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #27	C[Si](C)(C)OC[C@@H](O)[C@@H](O)[C@H](O[Si](C)(C)C)C(=CN(CCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3259.0	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #28	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)C(O[Si](C)(C)C)=C(CNCCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2950.3	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #28	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)C(O[Si](C)(C)C)=C(CNCCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2852.7	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #28	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)C(O[Si](C)(C)C)=C(CNCCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3075.5	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #29	C[Si](C)(C)N[C@H](CCCCN(CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O	2909.6	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #29	C[Si](C)(C)N[C@H](CCCCN(CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O	2817.9	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #29	C[Si](C)(C)N[C@H](CCCCN(CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O	3155.5	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #3	C[Si](C)(C)N[C@H](CCCCNC=C(O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)C(=O)O[Si](C)(C)C	2822.1	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #3	C[Si](C)(C)N[C@H](CCCCNC=C(O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)C(=O)O[Si](C)(C)C	2740.4	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #3	C[Si](C)(C)N[C@H](CCCCNC=C(O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)C(=O)O[Si](C)(C)C	3018.3	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #30	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)C(=CNCCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2966.4	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #30	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)C(=CNCCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2799.7	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #30	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)C(=CNCCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3139.1	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #31	C[Si](C)(C)N[C@H](CCCCN(C=C(O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O	2930.7	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #31	C[Si](C)(C)N[C@H](CCCCN(C=C(O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O	2717.1	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #31	C[Si](C)(C)N[C@H](CCCCN(C=C(O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O	3228.4	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #32	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)C(=O)CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3005.1	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #32	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)C(=O)CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	2885.5	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #32	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)C(=O)CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3091.4	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #33	C[Si](C)(C)OC(CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C	3055.1	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #33	C[Si](C)(C)OC(CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C	2866.2	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #33	C[Si](C)(C)OC(CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C	3185.9	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #34	C[Si](C)(C)OC(=CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C	3053.7	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #34	C[Si](C)(C)OC(=CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C	2789.2	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #34	C[Si](C)(C)OC(=CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C	3259.4	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #35	C[Si](C)(C)OC[C@@H](O)[C@@H](O[Si](C)(C)C)C(O[Si](C)(C)C)=C(CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3053.0	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #35	C[Si](C)(C)OC[C@@H](O)[C@@H](O[Si](C)(C)C)C(O[Si](C)(C)C)=C(CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2875.0	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #35	C[Si](C)(C)OC[C@@H](O)[C@@H](O[Si](C)(C)C)C(O[Si](C)(C)C)=C(CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3199.3	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #36	C[Si](C)(C)OC[C@@H](O)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)C(=CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3046.6	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #36	C[Si](C)(C)OC[C@@H](O)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)C(=CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2801.5	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #36	C[Si](C)(C)OC[C@@H](O)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)C(=CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3273.9	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #37	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O)C(O[Si](C)(C)C)=C(CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3050.0	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #37	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O)C(O[Si](C)(C)C)=C(CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2878.4	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #37	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O)C(O[Si](C)(C)C)=C(CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3219.1	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #38	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)C(=CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3054.0	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #38	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)C(=CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2807.0	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #38	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)C(=CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3295.1	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #39	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)C(O)=C(CNCCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2921.1	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #39	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)C(O)=C(CNCCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2891.9	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #39	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)C(O)=C(CNCCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3061.6	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #4	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)C(=CN(CCCC[C@@H](N)C(=O)O[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2844.2	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #4	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)C(=CN(CCCC[C@@H](N)C(=O)O[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2651.3	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #4	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)C(=CN(CCCC[C@@H](N)C(=O)O[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3579.1	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #40	C[Si](C)(C)N[C@H](CCCCN(CC(O[Si](C)(C)C)=C(O)[C@H](O[Si](C)(C)C)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	2851.2	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #40	C[Si](C)(C)N[C@H](CCCCN(CC(O[Si](C)(C)C)=C(O)[C@H](O[Si](C)(C)C)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	2845.4	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #40	C[Si](C)(C)N[C@H](CCCCN(CC(O[Si](C)(C)C)=C(O)[C@H](O[Si](C)(C)C)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	3112.9	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #41	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)C(=CNCCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2951.3	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #41	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)C(=CNCCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2839.5	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #41	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)C(=CNCCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3139.4	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #42	C[Si](C)(C)N[C@H](CCCCN(C=C(O[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	2874.7	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #42	C[Si](C)(C)N[C@H](CCCCN(C=C(O[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	2764.4	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #42	C[Si](C)(C)N[C@H](CCCCN(C=C(O[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	3196.6	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #43	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)C(=O)CN(CCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3008.0	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #43	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)C(=O)CN(CCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	2906.3	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #43	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)C(=O)CN(CCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3063.3	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #44	C[Si](C)(C)OC(=O)[C@@H](CCCCN(CC(O[Si](C)(C)C)=C(O)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3039.7	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #44	C[Si](C)(C)OC(=O)[C@@H](CCCCN(CC(O[Si](C)(C)C)=C(O)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2906.9	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #44	C[Si](C)(C)OC(=O)[C@@H](CCCCN(CC(O[Si](C)(C)C)=C(O)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3172.0	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #45	C[Si](C)(C)OC(=O)[C@@H](CCCCN(C=C(O[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3045.9	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #45	C[Si](C)(C)OC(=O)[C@@H](CCCCN(C=C(O[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2823.9	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #45	C[Si](C)(C)OC(=O)[C@@H](CCCCN(C=C(O[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3253.0	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #46	C[Si](C)(C)OC[C@@H](O)[C@@H](O[Si](C)(C)C)C(O)=C(CN(CCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3049.0	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #46	C[Si](C)(C)OC[C@@H](O)[C@@H](O[Si](C)(C)C)C(O)=C(CN(CCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2911.2	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #46	C[Si](C)(C)OC[C@@H](O)[C@@H](O[Si](C)(C)C)C(O)=C(CN(CCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3178.1	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #47	C[Si](C)(C)OC[C@@H](O)[C@@H](O[Si](C)(C)C)[C@H](O)C(=CN(CCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3045.3	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #47	C[Si](C)(C)OC[C@@H](O)[C@@H](O[Si](C)(C)C)[C@H](O)C(=CN(CCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2833.7	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #47	C[Si](C)(C)OC[C@@H](O)[C@@H](O[Si](C)(C)C)[C@H](O)C(=CN(CCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3261.9	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #48	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)C(O)=C(CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3055.3	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #48	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)C(O)=C(CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2899.4	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #48	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)C(O)=C(CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3239.2	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #49	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)C(=CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3057.2	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #49	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)C(=CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2823.7	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #49	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)C(=CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3323.5	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #5	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)C(=O)CNCCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2897.0	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #5	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)C(=O)CNCCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2887.8	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #5	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)C(=O)CNCCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2944.3	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #50	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O)C(O)=C(CN(CCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3051.7	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #50	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O)C(O)=C(CN(CCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2912.4	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #50	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O)C(O)=C(CN(CCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3221.4	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #51	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O)[C@H](O)C(=CN(CCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3042.8	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #51	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O)[C@H](O)C(=CN(CCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2837.5	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #51	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O)[C@H](O)C(=CN(CCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3301.4	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #6	C[Si](C)(C)N[C@H](CCCCN(CC(=O)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	2807.5	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #6	C[Si](C)(C)N[C@H](CCCCN(CC(=O)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	2844.5	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #6	C[Si](C)(C)N[C@H](CCCCN(CC(=O)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	2982.5	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #7	C[Si](C)(C)OC(=O)[C@@H](CCCCNCC(O[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2937.2	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #7	C[Si](C)(C)OC(=O)[C@@H](CCCCNCC(O[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2867.5	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #7	C[Si](C)(C)OC(=O)[C@@H](CCCCNCC(O[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2999.4	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #8	C[Si](C)(C)N[C@H](CCCCN(CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	2856.5	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #8	C[Si](C)(C)N[C@H](CCCCN(CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	2843.2	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #8	C[Si](C)(C)N[C@H](CCCCN(CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	3053.2	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #9	C[Si](C)(C)OC(=O)[C@@H](CCCCNC=C(O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2953.3	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #9	C[Si](C)(C)OC(=O)[C@@H](CCCCNC=C(O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2805.3	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,7TMS,isomer #9	C[Si](C)(C)OC(=O)[C@@H](CCCCNC=C(O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3059.0	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,8TMS,isomer #1	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)C(O[Si](C)(C)C)=C(CNCCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2955.4	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,8TMS,isomer #1	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)C(O[Si](C)(C)C)=C(CNCCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2920.4	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,8TMS,isomer #1	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)C(O[Si](C)(C)C)=C(CNCCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2970.0	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,8TMS,isomer #10	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O)C(O[Si](C)(C)C)=C(CN(CCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3079.3	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,8TMS,isomer #10	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O)C(O[Si](C)(C)C)=C(CN(CCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2937.3	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,8TMS,isomer #10	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O)C(O[Si](C)(C)C)=C(CN(CCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3069.1	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,8TMS,isomer #11	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)C(=CN(CCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3055.2	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,8TMS,isomer #11	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)C(=CN(CCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2863.3	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,8TMS,isomer #11	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)C(=CN(CCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3129.0	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,8TMS,isomer #12	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)C(O[Si](C)(C)C)=C(CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3083.3	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,8TMS,isomer #12	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)C(O[Si](C)(C)C)=C(CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2909.0	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,8TMS,isomer #12	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)C(O[Si](C)(C)C)=C(CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3098.3	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,8TMS,isomer #13	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)C(=CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3070.9	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,8TMS,isomer #13	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)C(=CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2839.2	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,8TMS,isomer #13	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)C(=CN(CCCC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3158.8	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,8TMS,isomer #14	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)C(O)=C(CN(CCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3061.3	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,8TMS,isomer #14	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)C(O)=C(CN(CCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2946.8	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,8TMS,isomer #14	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)C(O)=C(CN(CCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3085.0	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,8TMS,isomer #15	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)C(=CN(CCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3059.0	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,8TMS,isomer #15	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)C(=CN(CCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2878.4	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,8TMS,isomer #15	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)C(=CN(CCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3151.4	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,8TMS,isomer #2	C[Si](C)(C)N[C@H](CCCCN(CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	2875.5	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,8TMS,isomer #2	C[Si](C)(C)N[C@H](CCCCN(CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	2898.7	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,8TMS,isomer #2	C[Si](C)(C)N[C@H](CCCCN(CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	3007.1	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,8TMS,isomer #3	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)C(=CNCCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2970.2	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,8TMS,isomer #3	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)C(=CNCCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2860.6	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,8TMS,isomer #3	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)C(=CNCCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3011.1	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,8TMS,isomer #4	C[Si](C)(C)N[C@H](CCCCN(C=C(O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	2899.7	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,8TMS,isomer #4	C[Si](C)(C)N[C@H](CCCCN(C=C(O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	2790.5	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,8TMS,isomer #4	C[Si](C)(C)N[C@H](CCCCN(C=C(O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C	3059.2	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,8TMS,isomer #5	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)C(=O)CN(CCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3037.4	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,8TMS,isomer #5	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)C(=O)CN(CCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	2948.4	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,8TMS,isomer #5	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)C(=O)CN(CCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	2984.4	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,8TMS,isomer #6	C[Si](C)(C)OC(=O)[C@@H](CCCCN(CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3084.1	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,8TMS,isomer #6	C[Si](C)(C)OC(=O)[C@@H](CCCCN(CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2924.1	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,8TMS,isomer #6	C[Si](C)(C)OC(=O)[C@@H](CCCCN(CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3037.8	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,8TMS,isomer #7	C[Si](C)(C)OC(=O)[C@@H](CCCCN(C=C(O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3054.9	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,8TMS,isomer #7	C[Si](C)(C)OC(=O)[C@@H](CCCCN(C=C(O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2848.1	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,8TMS,isomer #7	C[Si](C)(C)OC(=O)[C@@H](CCCCN(C=C(O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3095.2	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,8TMS,isomer #8	C[Si](C)(C)OC[C@@H](O)[C@@H](O[Si](C)(C)C)C(O[Si](C)(C)C)=C(CN(CCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3076.8	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,8TMS,isomer #8	C[Si](C)(C)OC[C@@H](O)[C@@H](O[Si](C)(C)C)C(O[Si](C)(C)C)=C(CN(CCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2934.2	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,8TMS,isomer #8	C[Si](C)(C)OC[C@@H](O)[C@@H](O[Si](C)(C)C)C(O[Si](C)(C)C)=C(CN(CCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3052.2	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,8TMS,isomer #9	C[Si](C)(C)OC[C@@H](O)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)C(=CN(CCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3041.0	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,8TMS,isomer #9	C[Si](C)(C)OC[C@@H](O)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)C(=CN(CCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2856.0	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,8TMS,isomer #9	C[Si](C)(C)OC[C@@H](O)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)C(=CN(CCCC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	3111.1	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,4TBDMS,isomer #73	CC(C)(C)[Si](C)(C)OC[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)C(O)=C(CNCCCC[C@@H](N)C(=O)O)O[Si](C)(C)C(C)(C)C	3626.5	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,4TBDMS,isomer #73	CC(C)(C)[Si](C)(C)OC[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)C(O)=C(CNCCCC[C@@H](N)C(=O)O)O[Si](C)(C)C(C)(C)C	3341.9	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,4TBDMS,isomer #73	CC(C)(C)[Si](C)(C)OC[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)C(O)=C(CNCCCC[C@@H](N)C(=O)O)O[Si](C)(C)C(C)(C)C	4160.3	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,4TBDMS,isomer #74	CC(C)(C)[Si](C)(C)OC[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)C(=CNCCCC[C@@H](N)C(=O)O)O[Si](C)(C)C(C)(C)C	3657.0	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,4TBDMS,isomer #74	CC(C)(C)[Si](C)(C)OC[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)C(=CNCCCC[C@@H](N)C(=O)O)O[Si](C)(C)C(C)(C)C	3314.3	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,4TBDMS,isomer #74	CC(C)(C)[Si](C)(C)OC[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)C(=CNCCCC[C@@H](N)C(=O)O)O[Si](C)(C)C(C)(C)C	4186.5	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,5TBDMS,isomer #76	CC(C)(C)[Si](C)(C)OC[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)C(O)=C(CNCCCC[C@@H](N)C(=O)O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	3784.6	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,5TBDMS,isomer #76	CC(C)(C)[Si](C)(C)OC[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)C(O)=C(CNCCCC[C@@H](N)C(=O)O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	3461.6	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,5TBDMS,isomer #76	CC(C)(C)[Si](C)(C)OC[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)C(O)=C(CNCCCC[C@@H](N)C(=O)O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	3987.1	Standard polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,5TBDMS,isomer #77	CC(C)(C)[Si](C)(C)OC[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)C(=CNCCCC[C@@H](N)C(=O)O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	3840.1	Semi standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,5TBDMS,isomer #77	CC(C)(C)[Si](C)(C)OC[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)C(=CNCCCC[C@@H](N)C(=O)O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	3441.8	Standard non polar	33892256
(2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid,5TBDMS,isomer #77	CC(C)(C)[Si](C)(C)OC[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)C(=CNCCCC[C@@H](N)C(=O)O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	4005.1	Standard polar	33892256

Spectra

GC-MS Spectra

Spectrum Type	Description	Splash Key	Deposition Date	Source	View
Predicted GC-MS	Predicted GC-MS Spectrum - (2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid GC-MS (Non-derivatized) - 70eV, Positive	splash10-01ox-9640000000-d1a8c6941080cf41e7c6	2021-09-24	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - (2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid 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 - (2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid 10V, Positive-QTOF	splash10-052f-0194000000-3e93627d7e0f0f578855	2021-10-12	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - (2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid 20V, Positive-QTOF	splash10-053u-1920000000-d038d08ca9905a225efd	2021-10-12	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - (2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid 40V, Positive-QTOF	splash10-0089-9400000000-c539ac87786020033618	2021-10-12	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - (2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid 10V, Negative-QTOF	splash10-0a4r-6379000000-678201a6fc95ae82016e	2021-10-12	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - (2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid 20V, Negative-QTOF	splash10-0a4i-9130000000-3d5f71515c4e47529836	2021-10-12	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - (2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid 40V, Negative-QTOF	splash10-0a4l-9100000000-9612270f04ddc67d5630	2021-10-12	Wishart Lab	View Spectrum

NMR Spectra

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

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

Not Available

KNApSAcK ID

Not Available

Chemspider ID

110281

KEGG Compound ID

Not Available

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Not Available

METLIN ID

Not Available

PubChem Compound

123708

PDB ID

Not Available

ChEBI ID

Not Available

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

Kong SW, Hernandez-Ferrer C: Assessment of coverage for endogenous metabolites and exogenous chemical compounds using an untargeted metabolomics platform. Pac Symp Biocomput. 2020;25:587-598. [PubMed:31797630 ]

Showing metabocard for (2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid (HMDB0242138)

MOL for HMDB0242138 ((2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid)

3D MOL for HMDB0242138 ((2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid)

3D SDF for HMDB0242138 ((2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid)

3D-SDF for HMDB0242138 ((2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid)

PDB for HMDB0242138 ((2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid)

3D PDB for HMDB0242138 ((2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid)

SMILES for HMDB0242138 ((2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid)

INCHI for HMDB0242138 ((2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid)

Structure for HMDB0242138 ((2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid)

3D Structure for HMDB0242138 ((2R)-2-Amino-6-[[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino]hexanoic acid)

Predicted Collision Cross Sections

Predicted Kovats Retention Indices

Underivatized

Derivatized

GC-MS Spectra

MS/MS Spectra

NMR Spectra