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Showing metabocard for 2,6-Diamino-5-hydroxyhexanoic acid (HMDB0245508)

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Record Information
Version5.0
StatusDetected but not Quantified
Creation Date2021-09-10 22:34:21 UTC
Update Date2021-09-26 22:54:00 UTC
HMDB IDHMDB0245508
Secondary Accession NumbersNone
Metabolite Identification
Common Name2,6-Diamino-5-hydroxyhexanoic acid
Description2,6-Diamino-5-hydroxyhexanoic acid, also known as hydroxylysine or 5-hydroxy-2,6-diaminohexanoic acid, belongs to the class of organic compounds known as alpha amino acids. These are amino acids in which the amino group is attached to the carbon atom immediately adjacent to the carboxylate group (alpha carbon). 2,6-Diamino-5-hydroxyhexanoic acid exists in all living organisms, ranging from bacteria to humans. Based on a literature review very few articles have been published on 2,6-Diamino-5-hydroxyhexanoic acid. This compound has been identified in human blood as reported by (PMID: 31557052 ). 2,6-diamino-5-hydroxyhexanoic acid is not a naturally occurring metabolite and is only found in those individuals exposed to this compound or its derivatives. Technically 2,6-Diamino-5-hydroxyhexanoic acid is part of the human exposome. The exposome can be defined as the collection of all the exposures of an individual in a lifetime and how those exposures relate to health. An individual's exposure begins before birth and includes insults from environmental and occupational sources.
Structure
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MOL3D MOLSDF3D SDFPDB3D PDBSMILESInChI

MOL for HMDB0245508 (2,6-Diamino-5-hydroxyhexanoic acid)

Structure #1
  Mrv0541 02241206032D          

 11 10  0  0  0  0            999 V2000
    2.2539    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5395    0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6829    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9684    0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8250    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1105    0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3974    0.4125    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.8250   -0.8250    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.9684    1.2375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6039    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1105    1.2375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  3  4  1  0  0  0  0
  3  7  1  0  0  0  0
  4  9  1  0  0  0  0
  5  6  1  0  0  0  0
  5  8  1  0  0  0  0
  6 10  1  0  0  0  0
  6 11  2  0  0  0  0
M  END
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3D MOL for HMDB0245508 (2,6-Diamino-5-hydroxyhexanoic acid)

HMDB0245508
     RDKit          3D
2,6-Diamino-5-hydroxyhexanoic acid
 25 24  0  0  0  0  0  0  0  0999 V2000
   -2.3423    1.4669   -0.3943 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6472    0.3659    0.4360 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8389   -0.8681    0.2309 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9731   -1.3547   -1.0633 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4043   -0.7727    0.6865 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3691    0.2886   -0.0032 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7923    0.3400    0.5006 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4148    1.4313   -0.2723 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.5822   -0.8592    0.2543 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2969   -1.9326    0.8356 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6642   -0.8799   -0.6131 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3830    2.3997    0.0262 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6164    1.3980   -1.3781 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5026    0.6868    1.5044 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7261    0.0704    0.3519 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3040   -1.6629    0.8882 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6486   -2.0740   -1.1403 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0450   -1.7630    0.3722 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3732   -0.7554    1.7771 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4299    0.0238   -1.0820 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0379    1.3119    0.1458 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8218    0.6895    1.5608 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5573    1.0610   -1.2468 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3101    1.7303    0.1567 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5138   -0.3417   -0.4268 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
  3  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  7  9  1  0
  9 10  2  0
  9 11  1  0
  1 12  1  0
  1 13  1  0
  2 14  1  0
  2 15  1  0
  3 16  1  0
  4 17  1  0
  5 18  1  0
  5 19  1  0
  6 20  1  0
  6 21  1  0
  7 22  1  0
  8 23  1  0
  8 24  1  0
 11 25  1  0
M  END
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3D SDF for HMDB0245508 (2,6-Diamino-5-hydroxyhexanoic acid)

Structure #1
  Mrv0541 02241206032D          

 11 10  0  0  0  0            999 V2000
    2.2539    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5395    0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6829    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9684    0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8250    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1105    0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3974    0.4125    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.8250   -0.8250    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.9684    1.2375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6039    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1105    1.2375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  3  4  1  0  0  0  0
  3  7  1  0  0  0  0
  4  9  1  0  0  0  0
  5  6  1  0  0  0  0
  5  8  1  0  0  0  0
  6 10  1  0  0  0  0
  6 11  2  0  0  0  0
M  END
> <DATABASE_ID>
HMDB0245508

> <DATABASE_NAME>
hmdb

> <SMILES>
NCC(O)CCC(N)C(O)=O

> <INCHI_IDENTIFIER>
InChI=1S/C6H14N2O3/c7-3-4(9)1-2-5(8)6(10)11/h4-5,9H,1-3,7-8H2,(H,10,11)

> <INCHI_KEY>
YSMODUONRAFBET-UHFFFAOYSA-N

> <FORMULA>
C6H14N2O3

> <MOLECULAR_WEIGHT>
162.187

> <EXACT_MASS>
162.100442324

> <JCHEM_ACCEPTOR_COUNT>
5

> <JCHEM_AVERAGE_POLARIZABILITY>
16.64413262743744

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
4

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
2,6-diamino-5-hydroxyhexanoic acid

> <ALOGPS_LOGP>
-3.77

> <JCHEM_LOGP>
-4.414212989148229

> <ALOGPS_LOGS>
-0.12

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
1

> <JCHEM_PKA>
14.903490442523363

> <JCHEM_PKA_STRONGEST_ACIDIC>
2.4473857532646233

> <JCHEM_PKA_STRONGEST_BASIC>
9.746257700424144

> <JCHEM_POLAR_SURFACE_AREA>
109.57

> <JCHEM_REFRACTIVITY>
39.171

> <JCHEM_ROTATABLE_BOND_COUNT>
5

> <JCHEM_RULE_OF_FIVE>
1

> <ALOGPS_SOLUBILITY>
1.24e+02 g/l

> <JCHEM_TRADITIONAL_IUPAC>
5-hydroxylysine

> <JCHEM_VEBER_RULE>
0

$$$$
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3D-SDF for HMDB0245508 (2,6-Diamino-5-hydroxyhexanoic acid)

HMDB0245508
     RDKit          3D
2,6-Diamino-5-hydroxyhexanoic acid
 25 24  0  0  0  0  0  0  0  0999 V2000
   -2.3423    1.4669   -0.3943 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6472    0.3659    0.4360 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8389   -0.8681    0.2309 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9731   -1.3547   -1.0633 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4043   -0.7727    0.6865 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3691    0.2886   -0.0032 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7923    0.3400    0.5006 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4148    1.4313   -0.2723 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.5822   -0.8592    0.2543 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2969   -1.9326    0.8356 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6642   -0.8799   -0.6131 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3830    2.3997    0.0262 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6164    1.3980   -1.3781 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5026    0.6868    1.5044 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7261    0.0704    0.3519 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3040   -1.6629    0.8882 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6486   -2.0740   -1.1403 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0450   -1.7630    0.3722 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3732   -0.7554    1.7771 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4299    0.0238   -1.0820 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0379    1.3119    0.1458 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8218    0.6895    1.5608 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5573    1.0610   -1.2468 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3101    1.7303    0.1567 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5138   -0.3417   -0.4268 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
  3  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  7  9  1  0
  9 10  2  0
  9 11  1  0
  1 12  1  0
  1 13  1  0
  2 14  1  0
  2 15  1  0
  3 16  1  0
  4 17  1  0
  5 18  1  0
  5 19  1  0
  6 20  1  0
  6 21  1  0
  7 22  1  0
  8 23  1  0
  8 24  1  0
 11 25  1  0
M  END
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PDB for HMDB0245508 (2,6-Diamino-5-hydroxyhexanoic acid)

HEADER    PROTEIN                                 24-FEB-12   NONE
TITLE     NULL                                                        
COMPND    MOLECULE: Structure #1                                      
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   24-FEB-12         0                                  
HETATM    1  C   UNK     0       4.207   0.000   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0       2.874   0.770   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0       6.875   0.000   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0       5.541   0.770   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0       1.540   0.000   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0       0.206   0.770   0.000  0.00  0.00           C+0
HETATM    7  N   UNK     0       8.208   0.770   0.000  0.00  0.00           N+0
HETATM    8  N   UNK     0       1.540  -1.540   0.000  0.00  0.00           N+0
HETATM    9  O   UNK     0       5.541   2.310   0.000  0.00  0.00           O+0
HETATM   10  O   UNK     0      -1.127   0.000   0.000  0.00  0.00           O+0
HETATM   11  O   UNK     0       0.206   2.310   0.000  0.00  0.00           O+0
CONECT    1    2    4                                                       
CONECT    2    1    5                                                       
CONECT    3    4    7                                                       
CONECT    4    1    3    9                                                  
CONECT    5    2    6    8                                                  
CONECT    6    5   10   11                                                  
CONECT    7    3                                                            
CONECT    8    5                                                            
CONECT    9    4                                                            
CONECT   10    6                                                            
CONECT   11    6                                                            
MASTER        0    0    0    0    0    0    0    0   11    0   20    0
END
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3D PDB for HMDB0245508 (2,6-Diamino-5-hydroxyhexanoic acid)

COMPND    HMDB0245508
HETATM    1  N1  UNL     1      -2.342   1.467  -0.394  1.00  0.00           N  
HETATM    2  C1  UNL     1      -2.647   0.366   0.436  1.00  0.00           C  
HETATM    3  C2  UNL     1      -1.839  -0.868   0.231  1.00  0.00           C  
HETATM    4  O1  UNL     1      -1.973  -1.355  -1.063  1.00  0.00           O  
HETATM    5  C3  UNL     1      -0.404  -0.773   0.687  1.00  0.00           C  
HETATM    6  C4  UNL     1       0.369   0.289  -0.003  1.00  0.00           C  
HETATM    7  C5  UNL     1       1.792   0.340   0.501  1.00  0.00           C  
HETATM    8  N2  UNL     1       2.415   1.431  -0.272  1.00  0.00           N  
HETATM    9  C6  UNL     1       2.582  -0.859   0.254  1.00  0.00           C  
HETATM   10  O2  UNL     1       2.297  -1.933   0.836  1.00  0.00           O  
HETATM   11  O3  UNL     1       3.664  -0.880  -0.613  1.00  0.00           O  
HETATM   12  H1  UNL     1      -2.383   2.400   0.026  1.00  0.00           H  
HETATM   13  H2  UNL     1      -2.616   1.398  -1.378  1.00  0.00           H  
HETATM   14  H3  UNL     1      -2.503   0.687   1.504  1.00  0.00           H  
HETATM   15  H4  UNL     1      -3.726   0.070   0.352  1.00  0.00           H  
HETATM   16  H5  UNL     1      -2.304  -1.663   0.888  1.00  0.00           H  
HETATM   17  H6  UNL     1      -2.649  -2.074  -1.140  1.00  0.00           H  
HETATM   18  H7  UNL     1       0.045  -1.763   0.372  1.00  0.00           H  
HETATM   19  H8  UNL     1      -0.373  -0.755   1.777  1.00  0.00           H  
HETATM   20  H9  UNL     1       0.430   0.024  -1.082  1.00  0.00           H  
HETATM   21  H10 UNL     1      -0.038   1.312   0.146  1.00  0.00           H  
HETATM   22  H11 UNL     1       1.822   0.690   1.561  1.00  0.00           H  
HETATM   23  H12 UNL     1       2.557   1.061  -1.247  1.00  0.00           H  
HETATM   24  H13 UNL     1       3.310   1.730   0.157  1.00  0.00           H  
HETATM   25  H14 UNL     1       4.514  -0.342  -0.427  1.00  0.00           H  
CONECT    1    2   12   13
CONECT    2    3   14   15
CONECT    3    4    5   16
CONECT    4   17
CONECT    5    6   18   19
CONECT    6    7   20   21
CONECT    7    8    9   22
CONECT    8   23   24
CONECT    9   10   10   11
CONECT   11   25
END
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SMILES for HMDB0245508 (2,6-Diamino-5-hydroxyhexanoic acid)

NCC(O)CCC(N)C(O)=O
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INCHI for HMDB0245508 (2,6-Diamino-5-hydroxyhexanoic acid)

InChI=1S/C6H14N2O3/c7-3-4(9)1-2-5(8)6(10)11/h4-5,9H,1-3,7-8H2,(H,10,11)
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View in JSmolView NMR AssignmentsView Stereo Labels
Synonyms
ValueSource
5-Hydroxy-2,6-diaminohexanoic acidChEBI
HydroxylysineChEBI
HylChEBI
5-Hydroxy-2,6-diaminohexanoateGenerator
2,6-Diamino-5-hydroxyhexanoateGenerator
(2S,5R)-2,6-Diamino-5-hydroxyhexanoic acidHMDB
5 HydroxylysineHMDB
Lysine, 5 hydroxyHMDB
2,6 Diamino 5 hydroxyhexanoic acidHMDB
5-HydroxylysineHMDB
2,6-diamino-5-Hydroxyhexanoic acidChEBI
Chemical FormulaC6H14N2O3
Average Molecular Weight162.187
Monoisotopic Molecular Weight162.100442324
IUPAC Name2,6-diamino-5-hydroxyhexanoic acid
Traditional Name5-hydroxylysine
CAS Registry NumberNot Available
SMILES
NCC(O)CCC(N)C(O)=O
InChI Identifier
InChI=1S/C6H14N2O3/c7-3-4(9)1-2-5(8)6(10)11/h4-5,9H,1-3,7-8H2,(H,10,11)
InChI KeyYSMODUONRAFBET-UHFFFAOYSA-N
Chemical Taxonomy
Description Belongs to the class of organic compounds known as alpha amino acids. These are amino acids in which the amino group is attached to the carbon atom immediately adjacent to the carboxylate group (alpha carbon).
KingdomOrganic compounds
Super ClassOrganic acids and derivatives
ClassCarboxylic acids and derivatives
Sub ClassAmino acids, peptides, and analogues
Direct ParentAlpha amino acids
Alternative Parents
Substituents
  • Alpha-amino acid
  • Medium-chain fatty acid
  • Amino fatty acid
  • Hydroxy fatty acid
  • Fatty acyl
  • Fatty acid
  • 1,2-aminoalcohol
  • Amino acid
  • Secondary alcohol
  • Carboxylic acid
  • Monocarboxylic acid or derivatives
  • Organic nitrogen compound
  • Organooxygen compound
  • Organonitrogen compound
  • Primary amine
  • Primary aliphatic amine
  • Hydrocarbon derivative
  • Organic oxide
  • Carbonyl group
  • Organopnictogen compound
  • Amine
  • Organic oxygen compound
  • Alcohol
  • Aliphatic acyclic compound
Molecular FrameworkAliphatic acyclic compounds
External Descriptors
Ontology
Physiological effectNot Available
Disposition
Biological location
ProcessNot Available
RoleNot Available
Physical Properties
StateNot Available
Experimental Molecular Properties
PropertyValueReference
Melting PointNot AvailableNot Available
Boiling PointNot AvailableNot Available
Water SolubilityNot AvailableNot Available
LogPNot AvailableNot Available
Experimental Chromatographic PropertiesNot Available
Predicted Molecular Properties
PropertyValueSource
logP-3.8ALOGPS
logP-4.4ChemAxon
logS-0.12ALOGPS
pKa (Strongest Acidic)2.45ChemAxon
pKa (Strongest Basic)9.75ChemAxon
Physiological Charge1ChemAxon
Hydrogen Acceptor Count5ChemAxon
Hydrogen Donor Count4ChemAxon
Polar Surface Area109.57 ŲChemAxon
Rotatable Bond Count5ChemAxon
Refractivity39.17 m³·mol⁻¹ChemAxon
Polarizability16.64 ųChemAxon
Number of Rings0ChemAxon
BioavailabilityYesChemAxon
Rule of FiveYesChemAxon
Ghose FilterNoChemAxon
Veber's RuleNoChemAxon
MDDR-like RuleNoChemAxon
Predicted Chromatographic Properties

Predicted Collision Cross Sections

PredictorAdduct TypeCCS Value (Å2)Reference
DeepCCS[M+H]+132.2830932474
DeepCCS[M-H]-128.82530932474
DeepCCS[M-2H]-165.88230932474
DeepCCS[M+Na]+140.93330932474
AllCCS[M+H]+136.532859911
AllCCS[M+H-H2O]+132.632859911
AllCCS[M+NH4]+140.232859911
AllCCS[M+Na]+141.232859911
AllCCS[M-H]-130.432859911
AllCCS[M+Na-2H]-132.232859911
AllCCS[M+HCOO]-134.232859911

Predicted Kovats Retention Indices

Underivatized

MetaboliteSMILESKovats RI ValueColumn TypeReference
2,6-Diamino-5-hydroxyhexanoic acidNCC(O)CCC(N)C(O)=O1904.0Semi standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acidNCC(O)CCC(N)C(O)=O1904.0Semi standard non polar33892256

Derivatized

Derivative Name / StructureSMILESKovats RI ValueColumn TypeReference
2,6-Diamino-5-hydroxyhexanoic acid,1TMS,isomer #1C[Si](C)(C)OC(CN)CCC(N)C(=O)O1701.8Semi standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,1TMS,isomer #1C[Si](C)(C)OC(CN)CCC(N)C(=O)O1589.5Standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,1TMS,isomer #1C[Si](C)(C)OC(CN)CCC(N)C(=O)O3305.6Standard polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,2TMS,isomer #1C[Si](C)(C)OC(=O)C(N)CCC(CN)O[Si](C)(C)C1686.7Semi standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,2TMS,isomer #1C[Si](C)(C)OC(=O)C(N)CCC(CN)O[Si](C)(C)C1740.1Standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,2TMS,isomer #1C[Si](C)(C)OC(=O)C(N)CCC(CN)O[Si](C)(C)C2903.2Standard polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,2TMS,isomer #3C[Si](C)(C)NC(CCC(CN)O[Si](C)(C)C)C(=O)O1790.6Semi standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,2TMS,isomer #3C[Si](C)(C)NC(CCC(CN)O[Si](C)(C)C)C(=O)O1794.4Standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,2TMS,isomer #3C[Si](C)(C)NC(CCC(CN)O[Si](C)(C)C)C(=O)O2600.1Standard polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,2TMS,isomer #7C[Si](C)(C)N(CC(O)CCC(N)C(=O)O)[Si](C)(C)C1965.1Semi standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,2TMS,isomer #7C[Si](C)(C)N(CC(O)CCC(N)C(=O)O)[Si](C)(C)C1889.6Standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,2TMS,isomer #7C[Si](C)(C)N(CC(O)CCC(N)C(=O)O)[Si](C)(C)C3044.2Standard polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,3TMS,isomer #1C[Si](C)(C)NC(CCC(CN)O[Si](C)(C)C)C(=O)O[Si](C)(C)C1773.5Semi standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,3TMS,isomer #1C[Si](C)(C)NC(CCC(CN)O[Si](C)(C)C)C(=O)O[Si](C)(C)C1886.0Standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,3TMS,isomer #1C[Si](C)(C)NC(CCC(CN)O[Si](C)(C)C)C(=O)O[Si](C)(C)C2329.9Standard polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,3TMS,isomer #10C[Si](C)(C)NCC(O)CCC(C(=O)O)N([Si](C)(C)C)[Si](C)(C)C2073.7Semi standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,3TMS,isomer #10C[Si](C)(C)NCC(O)CCC(C(=O)O)N([Si](C)(C)C)[Si](C)(C)C1927.4Standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,3TMS,isomer #10C[Si](C)(C)NCC(O)CCC(C(=O)O)N([Si](C)(C)C)[Si](C)(C)C2365.9Standard polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,3TMS,isomer #2C[Si](C)(C)NCC(CCC(N)C(=O)O[Si](C)(C)C)O[Si](C)(C)C1771.1Semi standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,3TMS,isomer #2C[Si](C)(C)NCC(CCC(N)C(=O)O[Si](C)(C)C)O[Si](C)(C)C1896.4Standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,3TMS,isomer #2C[Si](C)(C)NCC(CCC(N)C(=O)O[Si](C)(C)C)O[Si](C)(C)C2393.0Standard polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,3TMS,isomer #3C[Si](C)(C)NCC(CCC(N[Si](C)(C)C)C(=O)O)O[Si](C)(C)C1856.9Semi standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,3TMS,isomer #3C[Si](C)(C)NCC(CCC(N[Si](C)(C)C)C(=O)O)O[Si](C)(C)C1917.9Standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,3TMS,isomer #3C[Si](C)(C)NCC(CCC(N[Si](C)(C)C)C(=O)O)O[Si](C)(C)C2272.5Standard polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,3TMS,isomer #4C[Si](C)(C)OC(CCC(N)C(=O)O)CN([Si](C)(C)C)[Si](C)(C)C2021.7Semi standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,3TMS,isomer #4C[Si](C)(C)OC(CCC(N)C(=O)O)CN([Si](C)(C)C)[Si](C)(C)C1968.8Standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,3TMS,isomer #4C[Si](C)(C)OC(CCC(N)C(=O)O)CN([Si](C)(C)C)[Si](C)(C)C2665.0Standard polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,3TMS,isomer #5C[Si](C)(C)OC(CN)CCC(C(=O)O)N([Si](C)(C)C)[Si](C)(C)C1981.3Semi standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,3TMS,isomer #5C[Si](C)(C)OC(CN)CCC(C(=O)O)N([Si](C)(C)C)[Si](C)(C)C1922.8Standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,3TMS,isomer #5C[Si](C)(C)OC(CN)CCC(C(=O)O)N([Si](C)(C)C)[Si](C)(C)C2439.7Standard polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,3TMS,isomer #6C[Si](C)(C)NCC(O)CCC(N[Si](C)(C)C)C(=O)O[Si](C)(C)C1867.8Semi standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,3TMS,isomer #6C[Si](C)(C)NCC(O)CCC(N[Si](C)(C)C)C(=O)O[Si](C)(C)C1882.2Standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,3TMS,isomer #6C[Si](C)(C)NCC(O)CCC(N[Si](C)(C)C)C(=O)O[Si](C)(C)C2219.8Standard polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,3TMS,isomer #7C[Si](C)(C)OC(=O)C(CCC(O)CN)N([Si](C)(C)C)[Si](C)(C)C1945.5Semi standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,3TMS,isomer #7C[Si](C)(C)OC(=O)C(CCC(O)CN)N([Si](C)(C)C)[Si](C)(C)C1908.4Standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,3TMS,isomer #7C[Si](C)(C)OC(=O)C(CCC(O)CN)N([Si](C)(C)C)[Si](C)(C)C2551.6Standard polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,3TMS,isomer #8C[Si](C)(C)OC(=O)C(N)CCC(O)CN([Si](C)(C)C)[Si](C)(C)C1957.6Semi standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,3TMS,isomer #8C[Si](C)(C)OC(=O)C(N)CCC(O)CN([Si](C)(C)C)[Si](C)(C)C1989.7Standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,3TMS,isomer #8C[Si](C)(C)OC(=O)C(N)CCC(O)CN([Si](C)(C)C)[Si](C)(C)C2484.9Standard polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,3TMS,isomer #9C[Si](C)(C)NC(CCC(O)CN([Si](C)(C)C)[Si](C)(C)C)C(=O)O2030.1Semi standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,3TMS,isomer #9C[Si](C)(C)NC(CCC(O)CN([Si](C)(C)C)[Si](C)(C)C)C(=O)O1972.8Standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,3TMS,isomer #9C[Si](C)(C)NC(CCC(O)CN([Si](C)(C)C)[Si](C)(C)C)C(=O)O2385.1Standard polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,4TMS,isomer #1C[Si](C)(C)NCC(CCC(N[Si](C)(C)C)C(=O)O[Si](C)(C)C)O[Si](C)(C)C1824.9Semi standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,4TMS,isomer #1C[Si](C)(C)NCC(CCC(N[Si](C)(C)C)C(=O)O[Si](C)(C)C)O[Si](C)(C)C1987.6Standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,4TMS,isomer #1C[Si](C)(C)NCC(CCC(N[Si](C)(C)C)C(=O)O[Si](C)(C)C)O[Si](C)(C)C1989.0Standard polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,4TMS,isomer #2C[Si](C)(C)OC(=O)C(CCC(CN)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C1962.4Semi standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,4TMS,isomer #2C[Si](C)(C)OC(=O)C(CCC(CN)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C2004.9Standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,4TMS,isomer #2C[Si](C)(C)OC(=O)C(CCC(CN)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C2282.6Standard polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,4TMS,isomer #3C[Si](C)(C)OC(=O)C(N)CCC(CN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C1985.8Semi standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,4TMS,isomer #3C[Si](C)(C)OC(=O)C(N)CCC(CN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C2030.9Standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,4TMS,isomer #3C[Si](C)(C)OC(=O)C(N)CCC(CN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C2347.0Standard polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,4TMS,isomer #4C[Si](C)(C)NC(CCC(CN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)C(=O)O2065.9Semi standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,4TMS,isomer #4C[Si](C)(C)NC(CCC(CN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)C(=O)O2043.0Standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,4TMS,isomer #4C[Si](C)(C)NC(CCC(CN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)C(=O)O2204.3Standard polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,4TMS,isomer #5C[Si](C)(C)NCC(CCC(C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C2034.4Semi standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,4TMS,isomer #5C[Si](C)(C)NCC(CCC(C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C2035.5Standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,4TMS,isomer #5C[Si](C)(C)NCC(CCC(C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C2162.8Standard polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,4TMS,isomer #6C[Si](C)(C)NC(CCC(O)CN([Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C2012.2Semi standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,4TMS,isomer #6C[Si](C)(C)NC(CCC(O)CN([Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C2046.0Standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,4TMS,isomer #6C[Si](C)(C)NC(CCC(O)CN([Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C2133.0Standard polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,4TMS,isomer #7C[Si](C)(C)NCC(O)CCC(C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C2037.7Semi standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,4TMS,isomer #7C[Si](C)(C)NCC(O)CCC(C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C1985.5Standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,4TMS,isomer #7C[Si](C)(C)NCC(O)CCC(C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C2155.9Standard polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,4TMS,isomer #8C[Si](C)(C)N(CC(O)CCC(C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C2189.6Semi standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,4TMS,isomer #8C[Si](C)(C)N(CC(O)CCC(C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C2110.0Standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,4TMS,isomer #8C[Si](C)(C)N(CC(O)CCC(C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C2274.5Standard polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,5TMS,isomer #1C[Si](C)(C)NC(CCC(CN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)C(=O)O[Si](C)(C)C2023.0Semi standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,5TMS,isomer #1C[Si](C)(C)NC(CCC(CN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)C(=O)O[Si](C)(C)C2095.5Standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,5TMS,isomer #1C[Si](C)(C)NC(CCC(CN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)C(=O)O[Si](C)(C)C1966.0Standard polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,5TMS,isomer #2C[Si](C)(C)NCC(CCC(C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C2012.7Semi standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,5TMS,isomer #2C[Si](C)(C)NCC(CCC(C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C2088.1Standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,5TMS,isomer #2C[Si](C)(C)NCC(CCC(C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C1957.0Standard polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,5TMS,isomer #3C[Si](C)(C)OC(CCC(C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)CN([Si](C)(C)C)[Si](C)(C)C2257.7Semi standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,5TMS,isomer #3C[Si](C)(C)OC(CCC(C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)CN([Si](C)(C)C)[Si](C)(C)C2154.5Standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,5TMS,isomer #3C[Si](C)(C)OC(CCC(C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)CN([Si](C)(C)C)[Si](C)(C)C2107.4Standard polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,5TMS,isomer #4C[Si](C)(C)OC(=O)C(CCC(O)CN([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C2211.4Semi standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,5TMS,isomer #4C[Si](C)(C)OC(=O)C(CCC(O)CN([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C2156.8Standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,5TMS,isomer #4C[Si](C)(C)OC(=O)C(CCC(O)CN([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C2079.0Standard polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,6TMS,isomer #1C[Si](C)(C)OC(=O)C(CCC(CN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C2337.9Semi standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,6TMS,isomer #1C[Si](C)(C)OC(=O)C(CCC(CN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C2198.1Standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,6TMS,isomer #1C[Si](C)(C)OC(=O)C(CCC(CN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C1969.9Standard polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,1TBDMS,isomer #1CC(C)(C)[Si](C)(C)OC(CN)CCC(N)C(=O)O1951.3Semi standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,1TBDMS,isomer #1CC(C)(C)[Si](C)(C)OC(CN)CCC(N)C(=O)O1809.3Standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,1TBDMS,isomer #1CC(C)(C)[Si](C)(C)OC(CN)CCC(N)C(=O)O3357.2Standard polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,1TBDMS,isomer #2CC(C)(C)[Si](C)(C)OC(=O)C(N)CCC(O)CN1922.9Semi standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,1TBDMS,isomer #2CC(C)(C)[Si](C)(C)OC(=O)C(N)CCC(O)CN1826.9Standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,1TBDMS,isomer #2CC(C)(C)[Si](C)(C)OC(=O)C(N)CCC(O)CN3286.9Standard polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,1TBDMS,isomer #3CC(C)(C)[Si](C)(C)NCC(O)CCC(N)C(=O)O2050.0Semi standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,1TBDMS,isomer #3CC(C)(C)[Si](C)(C)NCC(O)CCC(N)C(=O)O1889.1Standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,1TBDMS,isomer #3CC(C)(C)[Si](C)(C)NCC(O)CCC(N)C(=O)O3210.2Standard polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,1TBDMS,isomer #4CC(C)(C)[Si](C)(C)NC(CCC(O)CN)C(=O)O2022.3Semi standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,1TBDMS,isomer #4CC(C)(C)[Si](C)(C)NC(CCC(O)CN)C(=O)O1907.7Standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,1TBDMS,isomer #4CC(C)(C)[Si](C)(C)NC(CCC(O)CN)C(=O)O3096.9Standard polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,2TBDMS,isomer #1CC(C)(C)[Si](C)(C)OC(=O)C(N)CCC(CN)O[Si](C)(C)C(C)(C)C2142.1Semi standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,2TBDMS,isomer #1CC(C)(C)[Si](C)(C)OC(=O)C(N)CCC(CN)O[Si](C)(C)C(C)(C)C2184.9Standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,2TBDMS,isomer #1CC(C)(C)[Si](C)(C)OC(=O)C(N)CCC(CN)O[Si](C)(C)C(C)(C)C2906.7Standard polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,2TBDMS,isomer #4CC(C)(C)[Si](C)(C)NC(CCC(O)CN)C(=O)O[Si](C)(C)C(C)(C)C2215.0Semi standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,2TBDMS,isomer #4CC(C)(C)[Si](C)(C)NC(CCC(O)CN)C(=O)O[Si](C)(C)C(C)(C)C2212.3Standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,2TBDMS,isomer #4CC(C)(C)[Si](C)(C)NC(CCC(O)CN)C(=O)O[Si](C)(C)C(C)(C)C2689.8Standard polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,3TBDMS,isomer #1CC(C)(C)[Si](C)(C)NC(CCC(CN)O[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C2403.6Semi standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,3TBDMS,isomer #1CC(C)(C)[Si](C)(C)NC(CCC(CN)O[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C2459.3Standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,3TBDMS,isomer #1CC(C)(C)[Si](C)(C)NC(CCC(CN)O[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C2542.0Standard polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,3TBDMS,isomer #10CC(C)(C)[Si](C)(C)NCC(O)CCC(C(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C2709.2Semi standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,3TBDMS,isomer #10CC(C)(C)[Si](C)(C)NCC(O)CCC(C(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C2511.4Standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,3TBDMS,isomer #10CC(C)(C)[Si](C)(C)NCC(O)CCC(C(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C2575.5Standard polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,3TBDMS,isomer #2CC(C)(C)[Si](C)(C)NCC(CCC(N)C(=O)O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C2419.2Semi standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,3TBDMS,isomer #2CC(C)(C)[Si](C)(C)NCC(CCC(N)C(=O)O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C2502.5Standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,3TBDMS,isomer #2CC(C)(C)[Si](C)(C)NCC(CCC(N)C(=O)O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C2597.2Standard polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,3TBDMS,isomer #3CC(C)(C)[Si](C)(C)NCC(CCC(N[Si](C)(C)C(C)(C)C)C(=O)O)O[Si](C)(C)C(C)(C)C2528.1Semi standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,3TBDMS,isomer #3CC(C)(C)[Si](C)(C)NCC(CCC(N[Si](C)(C)C(C)(C)C)C(=O)O)O[Si](C)(C)C(C)(C)C2488.1Standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,3TBDMS,isomer #3CC(C)(C)[Si](C)(C)NCC(CCC(N[Si](C)(C)C(C)(C)C)C(=O)O)O[Si](C)(C)C(C)(C)C2527.4Standard polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,3TBDMS,isomer #4CC(C)(C)[Si](C)(C)OC(CCC(N)C(=O)O)CN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C2653.2Semi standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,3TBDMS,isomer #4CC(C)(C)[Si](C)(C)OC(CCC(N)C(=O)O)CN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C2571.7Standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,3TBDMS,isomer #4CC(C)(C)[Si](C)(C)OC(CCC(N)C(=O)O)CN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C2749.6Standard polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,3TBDMS,isomer #5CC(C)(C)[Si](C)(C)OC(CN)CCC(C(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C2609.2Semi standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,3TBDMS,isomer #5CC(C)(C)[Si](C)(C)OC(CN)CCC(C(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C2491.1Standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,3TBDMS,isomer #5CC(C)(C)[Si](C)(C)OC(CN)CCC(C(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C2597.7Standard polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,3TBDMS,isomer #6CC(C)(C)[Si](C)(C)NCC(O)CCC(N[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C2518.7Semi standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,3TBDMS,isomer #6CC(C)(C)[Si](C)(C)NCC(O)CCC(N[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C2477.4Standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,3TBDMS,isomer #6CC(C)(C)[Si](C)(C)NCC(O)CCC(N[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C2488.3Standard polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,3TBDMS,isomer #7CC(C)(C)[Si](C)(C)OC(=O)C(CCC(O)CN)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C2588.9Semi standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,3TBDMS,isomer #7CC(C)(C)[Si](C)(C)OC(=O)C(CCC(O)CN)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C2526.7Standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,3TBDMS,isomer #7CC(C)(C)[Si](C)(C)OC(=O)C(CCC(O)CN)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C2668.3Standard polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,3TBDMS,isomer #8CC(C)(C)[Si](C)(C)OC(=O)C(N)CCC(O)CN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C2608.4Semi standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,3TBDMS,isomer #8CC(C)(C)[Si](C)(C)OC(=O)C(N)CCC(O)CN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C2574.8Standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,3TBDMS,isomer #8CC(C)(C)[Si](C)(C)OC(=O)C(N)CCC(O)CN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C2641.1Standard polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,3TBDMS,isomer #9CC(C)(C)[Si](C)(C)NC(CCC(O)CN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O2708.7Semi standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,3TBDMS,isomer #9CC(C)(C)[Si](C)(C)NC(CCC(O)CN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O2560.6Standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,3TBDMS,isomer #9CC(C)(C)[Si](C)(C)NC(CCC(O)CN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O2597.7Standard polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,4TBDMS,isomer #1CC(C)(C)[Si](C)(C)NCC(CCC(N[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C2666.6Semi standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,4TBDMS,isomer #1CC(C)(C)[Si](C)(C)NCC(CCC(N[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C2682.9Standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,4TBDMS,isomer #1CC(C)(C)[Si](C)(C)NCC(CCC(N[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C2469.1Standard polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,4TBDMS,isomer #2CC(C)(C)[Si](C)(C)OC(=O)C(CCC(CN)O[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C2824.9Semi standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,4TBDMS,isomer #2CC(C)(C)[Si](C)(C)OC(=O)C(CCC(CN)O[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C2701.4Standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,4TBDMS,isomer #2CC(C)(C)[Si](C)(C)OC(=O)C(CCC(CN)O[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C2576.9Standard polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,4TBDMS,isomer #3CC(C)(C)[Si](C)(C)OC(=O)C(N)CCC(CN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C2836.2Semi standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,4TBDMS,isomer #3CC(C)(C)[Si](C)(C)OC(=O)C(N)CCC(CN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C2759.2Standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,4TBDMS,isomer #3CC(C)(C)[Si](C)(C)OC(=O)C(N)CCC(CN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C2636.6Standard polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,4TBDMS,isomer #4CC(C)(C)[Si](C)(C)NC(CCC(CN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)C(=O)O2941.3Semi standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,4TBDMS,isomer #4CC(C)(C)[Si](C)(C)NC(CCC(CN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)C(=O)O2748.8Standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,4TBDMS,isomer #4CC(C)(C)[Si](C)(C)NC(CCC(CN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)C(=O)O2572.9Standard polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,4TBDMS,isomer #5CC(C)(C)[Si](C)(C)NCC(CCC(C(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C2883.3Semi standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,4TBDMS,isomer #5CC(C)(C)[Si](C)(C)NCC(CCC(C(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C2720.2Standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,4TBDMS,isomer #5CC(C)(C)[Si](C)(C)NCC(CCC(C(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C2539.5Standard polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,4TBDMS,isomer #6CC(C)(C)[Si](C)(C)NC(CCC(O)CN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C2886.2Semi standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,4TBDMS,isomer #6CC(C)(C)[Si](C)(C)NC(CCC(O)CN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C2772.4Standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,4TBDMS,isomer #6CC(C)(C)[Si](C)(C)NC(CCC(O)CN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C2527.8Standard polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,4TBDMS,isomer #7CC(C)(C)[Si](C)(C)NCC(O)CCC(C(=O)O[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C2914.0Semi standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,4TBDMS,isomer #7CC(C)(C)[Si](C)(C)NCC(O)CCC(C(=O)O[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C2718.8Standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,4TBDMS,isomer #7CC(C)(C)[Si](C)(C)NCC(O)CCC(C(=O)O[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C2533.3Standard polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,4TBDMS,isomer #8CC(C)(C)[Si](C)(C)N(CC(O)CCC(C(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C3030.3Semi standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,4TBDMS,isomer #8CC(C)(C)[Si](C)(C)N(CC(O)CCC(C(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C2808.8Standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,4TBDMS,isomer #8CC(C)(C)[Si](C)(C)N(CC(O)CCC(C(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C2597.8Standard polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,5TBDMS,isomer #1CC(C)(C)[Si](C)(C)NC(CCC(CN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C3078.8Semi standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,5TBDMS,isomer #1CC(C)(C)[Si](C)(C)NC(CCC(CN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C2934.2Standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,5TBDMS,isomer #1CC(C)(C)[Si](C)(C)NC(CCC(CN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C2524.6Standard polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,5TBDMS,isomer #2CC(C)(C)[Si](C)(C)NCC(CCC(C(=O)O[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C3075.4Semi standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,5TBDMS,isomer #2CC(C)(C)[Si](C)(C)NCC(CCC(C(=O)O[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C2922.0Standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,5TBDMS,isomer #2CC(C)(C)[Si](C)(C)NCC(CCC(C(=O)O[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C2516.8Standard polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,5TBDMS,isomer #3CC(C)(C)[Si](C)(C)OC(CCC(C(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)CN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C3268.0Semi standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,5TBDMS,isomer #3CC(C)(C)[Si](C)(C)OC(CCC(C(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)CN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C2975.4Standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,5TBDMS,isomer #3CC(C)(C)[Si](C)(C)OC(CCC(C(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)CN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C2571.5Standard polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,5TBDMS,isomer #4CC(C)(C)[Si](C)(C)OC(=O)C(CCC(O)CN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C3255.2Semi standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,5TBDMS,isomer #4CC(C)(C)[Si](C)(C)OC(=O)C(CCC(O)CN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C3003.0Standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,5TBDMS,isomer #4CC(C)(C)[Si](C)(C)OC(=O)C(CCC(O)CN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C2557.7Standard polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,6TBDMS,isomer #1CC(C)(C)[Si](C)(C)OC(=O)C(CCC(CN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C3512.5Semi standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,6TBDMS,isomer #1CC(C)(C)[Si](C)(C)OC(=O)C(CCC(CN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C3191.3Standard non polar33892256
2,6-Diamino-5-hydroxyhexanoic acid,6TBDMS,isomer #1CC(C)(C)[Si](C)(C)OC(=O)C(CCC(CN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C2597.8Standard polar33892256
Spectra

GC-MS Spectra

Spectrum TypeDescriptionSplash KeyDeposition DateSourceView
Predicted GC-MSPredicted GC-MS Spectrum - 2,6-Diamino-5-hydroxyhexanoic acid GC-MS (Non-derivatized) - 70eV, Positivesplash10-001i-9200000000-ef3e4f2b335f933719392021-09-23Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - 2,6-Diamino-5-hydroxyhexanoic acid GC-MS (Non-derivatized) - 70eV, PositiveNot Available2021-10-12Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - 2,6-Diamino-5-hydroxyhexanoic acid GC-MS (Non-derivatized) - 70eV, PositiveNot Available2021-10-12Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - 2,6-Diamino-5-hydroxyhexanoic acid GC-MS (TMS_1_2) - 70eV, PositiveNot Available2021-11-03Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - 2,6-Diamino-5-hydroxyhexanoic acid GC-MS (TMS_1_3) - 70eV, PositiveNot Available2021-11-03Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - 2,6-Diamino-5-hydroxyhexanoic acid GC-MS (TMS_1_4) - 70eV, PositiveNot Available2021-11-03Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - 2,6-Diamino-5-hydroxyhexanoic acid GC-MS (TMS_2_2) - 70eV, PositiveNot Available2021-11-03Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - 2,6-Diamino-5-hydroxyhexanoic acid GC-MS (TMS_2_4) - 70eV, PositiveNot Available2021-11-03Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - 2,6-Diamino-5-hydroxyhexanoic acid GC-MS (TMS_2_5) - 70eV, PositiveNot Available2021-11-03Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - 2,6-Diamino-5-hydroxyhexanoic acid GC-MS (TMS_2_6) - 70eV, PositiveNot Available2021-11-03Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - 2,6-Diamino-5-hydroxyhexanoic acid GC-MS (TMS_2_8) - 70eV, PositiveNot Available2021-11-03Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - 2,6-Diamino-5-hydroxyhexanoic acid GC-MS (TBDMS_2_2) - 70eV, PositiveNot Available2021-11-03Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - 2,6-Diamino-5-hydroxyhexanoic acid GC-MS (TBDMS_2_3) - 70eV, PositiveNot Available2021-11-03Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - 2,6-Diamino-5-hydroxyhexanoic acid GC-MS (TBDMS_2_5) - 70eV, PositiveNot Available2021-11-03Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - 2,6-Diamino-5-hydroxyhexanoic acid GC-MS (TBDMS_2_6) - 70eV, PositiveNot Available2021-11-03Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - 2,6-Diamino-5-hydroxyhexanoic acid GC-MS (TBDMS_2_7) - 70eV, PositiveNot Available2021-11-03Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - 2,6-Diamino-5-hydroxyhexanoic acid GC-MS (TBDMS_2_8) - 70eV, PositiveNot Available2021-11-03Wishart LabView Spectrum

MS/MS Spectra

Spectrum TypeDescriptionSplash KeyDeposition DateSourceView
Experimental LC-MS/MSLC-MS/MS Spectrum - 2,6-Diamino-5-hydroxyhexanoic acid 10V, Positive-QTOFsplash10-004i-3900000000-3089dfc8905f4286b17e2021-09-20HMDB team, MONAView Spectrum
Experimental LC-MS/MSLC-MS/MS Spectrum - 2,6-Diamino-5-hydroxyhexanoic acid 35V, Positive-QTOFsplash10-004i-3900000000-e7e94bdf191bf106a06f2021-09-20HMDB team, MONAView Spectrum
Experimental LC-MS/MSLC-MS/MS Spectrum - 2,6-Diamino-5-hydroxyhexanoic acid 35V, Positive-QTOFsplash10-004i-3900000000-79cdd26af9382190d3a42021-09-20HMDB team, MONAView Spectrum
Experimental LC-MS/MSLC-MS/MS Spectrum - 2,6-Diamino-5-hydroxyhexanoic acid 20V, Positive-QTOFsplash10-0a59-9000000000-e7fe99355878f60bf81e2021-09-20HMDB team, MONAView Spectrum
Experimental LC-MS/MSLC-MS/MS Spectrum - 2,6-Diamino-5-hydroxyhexanoic acid 10V, Positive-QTOFsplash10-0059-6900000000-ed33612abd64828ef9c62021-09-20HMDB team, MONAView Spectrum
Experimental LC-MS/MSLC-MS/MS Spectrum - 2,6-Diamino-5-hydroxyhexanoic acid 20V, Positive-QTOFsplash10-0a59-9100000000-c790704a726da1b8695c2021-09-20HMDB team, MONAView Spectrum
Experimental LC-MS/MSLC-MS/MS Spectrum - 2,6-Diamino-5-hydroxyhexanoic acid 40V, Positive-QTOFsplash10-0a4i-9000000000-2824811b9dd50ea8a60e2021-09-20HMDB team, MONAView Spectrum
Experimental LC-MS/MSLC-MS/MS Spectrum - 2,6-Diamino-5-hydroxyhexanoic acid 10V, Negative-QTOFsplash10-03di-0900000000-45b4a6f42d73c089ee752021-09-20HMDB team, MONAView Spectrum
Experimental LC-MS/MSLC-MS/MS Spectrum - 2,6-Diamino-5-hydroxyhexanoic acid 35V, Negative-QTOFsplash10-03di-0900000000-7ead58c25b3eaaa23a6a2021-09-20HMDB team, MONAView Spectrum
Experimental LC-MS/MSLC-MS/MS Spectrum - 2,6-Diamino-5-hydroxyhexanoic acid 40V, Positive-QTOFsplash10-0a4i-9000000000-a3b09ba62a111bc8f6782021-09-20HMDB team, MONAView Spectrum
Experimental LC-MS/MSLC-MS/MS Spectrum - 2,6-Diamino-5-hydroxyhexanoic acid 20V, Positive-QTOFsplash10-0a59-9200000000-8d339cf95a35492a1acc2021-09-20HMDB team, MONAView Spectrum
Experimental LC-MS/MSLC-MS/MS Spectrum - 2,6-Diamino-5-hydroxyhexanoic acid 10V, Positive-QTOFsplash10-0059-5900000000-43f6ab46f3ec777979672021-09-20HMDB team, MONAView Spectrum
Experimental LC-MS/MSLC-MS/MS Spectrum - 2,6-Diamino-5-hydroxyhexanoic acid 20V, Positive-QTOFsplash10-053r-9100000000-8762c9d8b98e36e4c9d42021-09-20HMDB team, MONAView Spectrum
Experimental LC-MS/MSLC-MS/MS Spectrum - 2,6-Diamino-5-hydroxyhexanoic acid 40V, Positive-QTOFsplash10-0a4i-9000000000-9a23a74dbca554fe7cad2021-09-20HMDB team, MONAView Spectrum
Experimental LC-MS/MSLC-MS/MS Spectrum - 2,6-Diamino-5-hydroxyhexanoic acid 10V, Positive-QTOFsplash10-003r-9800000000-ce508a644c58a63de7872021-09-20HMDB team, MONAView Spectrum
Experimental LC-MS/MSLC-MS/MS Spectrum - 2,6-Diamino-5-hydroxyhexanoic acid 40V, Positive-QTOFsplash10-0a4i-9000000000-ccffc2ae3ec49b11f8ff2021-09-20HMDB team, MONAView Spectrum
Experimental LC-MS/MSLC-MS/MS Spectrum - 2,6-Diamino-5-hydroxyhexanoic acid 30V, Positive-QTOFsplash10-0a4i-9000000000-a0459658e1828d3139e32021-09-20HMDB team, MONAView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 2,6-Diamino-5-hydroxyhexanoic acid 10V, Positive-QTOFsplash10-0002-2900000000-8397d61d545e023601702019-02-22Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 2,6-Diamino-5-hydroxyhexanoic acid 20V, Positive-QTOFsplash10-0002-4900000000-48078f30df6b8a1a9d372019-02-22Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 2,6-Diamino-5-hydroxyhexanoic acid 40V, Positive-QTOFsplash10-0002-9200000000-704df3496ba8b8e281fc2019-02-22Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 2,6-Diamino-5-hydroxyhexanoic acid 10V, Negative-QTOFsplash10-03di-0900000000-48c24e873791413fa2f62019-02-23Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 2,6-Diamino-5-hydroxyhexanoic acid 20V, Negative-QTOFsplash10-01ox-2900000000-b7b2cb38f33bdc9d990c2019-02-23Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 2,6-Diamino-5-hydroxyhexanoic acid 40V, Negative-QTOFsplash10-00fu-9300000000-38377b6e0a4b5c1edf9a2019-02-23Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 2,6-Diamino-5-hydroxyhexanoic acid 10V, Positive-QTOFsplash10-03xs-0900000000-7da81920db6fb9d86cad2021-10-12Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 2,6-Diamino-5-hydroxyhexanoic acid 20V, Positive-QTOFsplash10-0zfr-5900000000-aa61b5defc89773da5d72021-10-12Wishart LabView Spectrum

NMR Spectra

Spectrum TypeDescriptionDeposition DateSourceView
Predicted 1D NMR13C NMR Spectrum (1D, 100 MHz, D2O, predicted)2021-10-12Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 100 MHz, D2O, predicted)2021-10-12Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 1000 MHz, D2O, predicted)2021-10-12Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 1000 MHz, D2O, predicted)2021-10-12Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 200 MHz, D2O, predicted)2021-10-12Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 200 MHz, D2O, predicted)2021-10-12Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 300 MHz, D2O, predicted)2021-10-12Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 300 MHz, D2O, predicted)2021-10-12Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 400 MHz, D2O, predicted)2021-10-12Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 400 MHz, D2O, predicted)2021-10-12Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 500 MHz, D2O, predicted)2021-10-12Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 500 MHz, D2O, predicted)2021-10-12Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 600 MHz, D2O, predicted)2021-10-12Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 600 MHz, D2O, predicted)2021-10-12Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 700 MHz, D2O, predicted)2021-10-12Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 700 MHz, D2O, predicted)2021-10-12Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 800 MHz, D2O, predicted)2021-10-12Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 800 MHz, D2O, predicted)2021-10-12Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 900 MHz, D2O, predicted)2021-10-12Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 900 MHz, D2O, predicted)2021-10-12Wishart LabView Spectrum
Biological Properties
Cellular LocationsNot Available
Biospecimen Locations
  • Blood
Tissue LocationsNot Available
Pathways
Normal Concentrations
BiospecimenStatusValueAgeSexConditionReferenceDetails
BloodDetected but not QuantifiedNot QuantifiedNot SpecifiedNot SpecifiedNormal details
Abnormal Concentrations
Not Available
Associated Disorders and Diseases
Disease ReferencesNone
Associated OMIM IDsNone
DrugBank IDNot Available
Phenol Explorer Compound IDNot Available
FooDB IDNot Available
KNApSAcK IDNot Available
Chemspider ID1002
KEGG Compound IDNot Available
BioCyc IDCPD-7689
BiGG IDNot Available
Wikipedia LinkHydroxylysine
METLIN IDNot Available
PubChem Compound1029
PDB IDNot Available
ChEBI ID60175
Food Biomarker OntologyNot Available
VMH IDNot Available
MarkerDB IDNot Available
Good Scents IDNot Available
References
Synthesis ReferenceNot Available
Material Safety Data Sheet (MSDS)Not Available
General References
  1. Barupal DK, Fiehn O: Generating the Blood Exposome Database Using a Comprehensive Text Mining and Database Fusion Approach. Environ Health Perspect. 2019 Sep;127(9):97008. doi: 10.1289/EHP4713. Epub 2019 Sep 26. [PubMed:31557052 ]