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Record Information

Version

5.0

Status

Expected but not Quantified

Creation Date

2012-09-11 18:24:57 UTC

Update Date

2022-03-07 02:53:48 UTC

HMDB ID

HMDB0033664

Secondary Accession Numbers

HMDB33664

Metabolite Identification

Common Name

N'-Hydroxysaxitoxin

Description

N'-Hydroxysaxitoxin belongs to the class of organic compounds known as saxitoxins, gonyautoxins, and derivatives. Saxitoxins, gonyautoxins, and derivatives are compounds with a structure based on a 2,6-diamino-4-methyl-pyrrolo[1,2-c]purin-10-ol skeleton. Based on a literature review very few articles have been published on N'-Hydroxysaxitoxin.

Structure

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

HMDB0033664
     RDKit          3D
N'-Hydroxysaxitoxin
 39 41  0  0  0  0  0  0  0  0999 V2000
   -0.8040    1.8589    3.0368 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7647    1.0464    2.0317 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2753    1.0245    1.0169 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0392   -0.1985    0.3495 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7325   -0.5596   -0.8775 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2003   -0.7889   -0.5731 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8272    0.4067   -0.1606 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.1754    0.3817    0.1595 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7733   -0.7202    0.0632 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8811    1.5349    0.5818 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.1734    1.4716    0.8801 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2067   -1.8789   -1.2926 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1314   -2.2582   -0.8906 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5012   -3.4848   -1.0259 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0255   -1.2989   -0.3656 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4445   -1.0803   -0.3315 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5744    0.4590   -0.4140 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1077    0.9498   -0.4190 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7389    1.0557   -1.7405 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0622    2.1400    0.2623 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4613   -0.1970    0.3063 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7245    0.0008    1.7006 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0905    2.5798    3.2169 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9876    1.7570    0.8684 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2731   -1.0126    1.1174 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6839    0.1522   -1.7098 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3032   -1.5637    0.2425 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7376   -1.2417   -1.4455 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3657    2.4324    0.6533 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.6403    0.7275    0.3908 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8364   -2.4629   -1.8562 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8470   -4.1883   -1.4179 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8202   -1.4570    0.6393 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9890   -1.5540   -1.1723 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1070    0.7706   -1.3107 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0873    0.7747    0.5165 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3190    1.9407   -1.9242 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1346    2.8986   -0.3812 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3774   -0.4182    2.3709 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  3
  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  2  0
  8 10  1  0
 10 11  1  0
  5 12  1  0
 12 13  1  0
 13 14  2  3
 13 15  1  0
 15 16  1  0
 16 17  1  0
 17 18  1  0
 18 19  1  0
 18 20  1  0
 18 21  1  0
 21 22  1  0
 22  2  1  0
 21  4  1  0
 21 15  1  0
  1 23  1  0
  3 24  1  0
  4 25  1  0
  5 26  1  0
  6 27  1  0
  6 28  1  0
 10 29  1  0
 11 30  1  0
 12 31  1  0
 14 32  1  0
 16 33  1  0
 16 34  1  0
 17 35  1  0
 17 36  1  0
 19 37  1  0
 20 38  1  0
 22 39  1  0
M  END


  Mrv0541 05061307162D          

 22 24  0  0  0  0            999 V2000
    0.4922   -1.5235    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2067   -1.1110    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2067   -0.2860    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4922    0.1265    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4922    0.9515    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2924    1.2064    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2924   -0.1285    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7773    0.5390    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6023    0.5390    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.6356    1.3640    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.9212    0.9515    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2067    1.3640    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.0352    2.1709    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2147    2.2572    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1209    1.5035    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6808    2.1954    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9212    0.1265    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9081    1.7502    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4922   -2.3485    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2067   -2.7610    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2222   -2.7610    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2222   -3.5860    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 19  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  3 17  1  0  0  0  0
  4  5  1  0  0  0  0
  4  7  1  0  0  0  0
  5  6  1  0  0  0  0
  5 12  1  0  0  0  0
  5 15  1  0  0  0  0
  6  8  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  2  0  0  0  0
 10 11  2  0  0  0  0
 11 12  1  0  0  0  0
 11 17  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
 15 18  1  0  0  0  0
 19 20  2  0  0  0  0
 19 21  1  0  0  0  0
 21 22  1  0  0  0  0
M  END
> <DATABASE_ID>
HMDB0033664

> <DATABASE_NAME>
hmdb

> <SMILES>
ONC(=O)OCC1NC(=N)N2CCC(O)(O)C22NC(=N)NC12

> <INCHI_IDENTIFIER>
InChI=1S/C10H17N7O5/c11-6-14-5-4(3-22-8(18)16-21)13-7(12)17-2-1-9(19,20)10(5,17)15-6/h4-5,19-21H,1-3H2,(H2,12,13)(H,16,18)(H3,11,14,15)

> <INCHI_KEY>
AGUPJSLCNZPQMF-UHFFFAOYSA-N

> <FORMULA>
C10H17N7O5

> <MOLECULAR_WEIGHT>
315.2859

> <EXACT_MASS>
315.129116689

> <JCHEM_ACCEPTOR_COUNT>
10

> <JCHEM_AVERAGE_POLARIZABILITY>
28.81495403741357

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
9

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
{10,10-dihydroxy-2,6-diimino-decahydropyrrolo[1,2-c]purin-4-yl}methyl N-hydroxycarbamate

> <ALOGPS_LOGP>
-2.27

> <JCHEM_LOGP>
-3.0188836435021047

> <ALOGPS_LOGS>
-2.05

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
3

> <JCHEM_PHYSIOLOGICAL_CHARGE>
2

> <JCHEM_PKA>
10.962967393838412

> <JCHEM_PKA_STRONGEST_ACIDIC>
8.298377263819631

> <JCHEM_PKA_STRONGEST_BASIC>
10.425666089837902

> <JCHEM_POLAR_SURFACE_AREA>
186.04999999999998

> <JCHEM_REFRACTIVITY>
90.187

> <JCHEM_ROTATABLE_BOND_COUNT>
3

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
2.80e+00 g/l

> <JCHEM_TRADITIONAL_IUPAC>
{10,10-dihydroxy-2,6-diimino-hexahydro-1H-pyrrolo[1,2-c]purin-4-yl}methyl N-hydroxycarbamate

> <JCHEM_VEBER_RULE>
0

$$$$

HMDB0033664
     RDKit          3D
N'-Hydroxysaxitoxin
 39 41  0  0  0  0  0  0  0  0999 V2000
   -0.8040    1.8589    3.0368 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7647    1.0464    2.0317 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2753    1.0245    1.0169 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0392   -0.1985    0.3495 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7325   -0.5596   -0.8775 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2003   -0.7889   -0.5731 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8272    0.4067   -0.1606 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.1754    0.3817    0.1595 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7733   -0.7202    0.0632 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8811    1.5349    0.5818 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.1734    1.4716    0.8801 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2067   -1.8789   -1.2926 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1314   -2.2582   -0.8906 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5012   -3.4848   -1.0259 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0255   -1.2989   -0.3656 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4445   -1.0803   -0.3315 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5744    0.4590   -0.4140 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1077    0.9498   -0.4190 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7389    1.0557   -1.7405 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0622    2.1400    0.2623 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4613   -0.1970    0.3063 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7245    0.0008    1.7006 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0905    2.5798    3.2169 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9876    1.7570    0.8684 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2731   -1.0126    1.1174 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6839    0.1522   -1.7098 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3032   -1.5637    0.2425 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7376   -1.2417   -1.4455 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3657    2.4324    0.6533 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.6403    0.7275    0.3908 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8364   -2.4629   -1.8562 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8470   -4.1883   -1.4179 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8202   -1.4570    0.6393 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9890   -1.5540   -1.1723 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1070    0.7706   -1.3107 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0873    0.7747    0.5165 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3190    1.9407   -1.9242 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1346    2.8986   -0.3812 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3774   -0.4182    2.3709 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  3
  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  2  0
  8 10  1  0
 10 11  1  0
  5 12  1  0
 12 13  1  0
 13 14  2  3
 13 15  1  0
 15 16  1  0
 16 17  1  0
 17 18  1  0
 18 19  1  0
 18 20  1  0
 18 21  1  0
 21 22  1  0
 22  2  1  0
 21  4  1  0
 21 15  1  0
  1 23  1  0
  3 24  1  0
  4 25  1  0
  5 26  1  0
  6 27  1  0
  6 28  1  0
 10 29  1  0
 11 30  1  0
 12 31  1  0
 14 32  1  0
 16 33  1  0
 16 34  1  0
 17 35  1  0
 17 36  1  0
 19 37  1  0
 20 38  1  0
 22 39  1  0
M  END

HEADER    PROTEIN                                 06-MAY-13   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   06-MAY-13         0                                  
HETATM    1  O   UNK     0       0.919  -2.844   0.000  0.00  0.00           O+0
HETATM    2  C   UNK     0       2.253  -2.074   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0       2.253  -0.534   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0       0.919   0.236   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0       0.919   1.776   0.000  0.00  0.00           C+0
HETATM    6  N   UNK     0      -0.546   2.252   0.000  0.00  0.00           N+0
HETATM    7  N   UNK     0      -0.546  -0.240   0.000  0.00  0.00           N+0
HETATM    8  C   UNK     0      -1.451   1.006   0.000  0.00  0.00           C+0
HETATM    9  N   UNK     0      -2.991   1.006   0.000  0.00  0.00           N+0
HETATM   10  N   UNK     0       4.920   2.546   0.000  0.00  0.00           N+0
HETATM   11  C   UNK     0       3.586   1.776   0.000  0.00  0.00           C+0
HETATM   12  N   UNK     0       2.253   2.546   0.000  0.00  0.00           N+0
HETATM   13  C   UNK     0       1.932   4.052   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0       0.401   4.213   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0      -0.226   2.807   0.000  0.00  0.00           C+0
HETATM   16  O   UNK     0      -1.271   4.098   0.000  0.00  0.00           O+0
HETATM   17  N   UNK     0       3.586   0.236   0.000  0.00  0.00           N+0
HETATM   18  O   UNK     0      -1.695   3.267   0.000  0.00  0.00           O+0
HETATM   19  C   UNK     0       0.919  -4.384   0.000  0.00  0.00           C+0
HETATM   20  O   UNK     0       2.253  -5.154   0.000  0.00  0.00           O+0
HETATM   21  N   UNK     0      -0.415  -5.154   0.000  0.00  0.00           N+0
HETATM   22  O   UNK     0      -0.415  -6.694   0.000  0.00  0.00           O+0
CONECT    1    2   19                                                       
CONECT    2    1    3                                                       
CONECT    3    2    4   17                                                  
CONECT    4    3    5    7                                                  
CONECT    5    4    6   12   15                                             
CONECT    6    5    8                                                       
CONECT    7    4    8                                                       
CONECT    8    6    7    9                                                  
CONECT    9    8                                                            
CONECT   10   11                                                            
CONECT   11   10   12   17                                                  
CONECT   12    5   11   13                                                  
CONECT   13   12   14                                                       
CONECT   14   13   15                                                       
CONECT   15    5   14   16   18                                             
CONECT   16   15                                                            
CONECT   17    3   11                                                       
CONECT   18   15                                                            
CONECT   19    1   20   21                                                  
CONECT   20   19                                                            
CONECT   21   19   22                                                       
CONECT   22   21                                                            
MASTER        0    0    0    0    0    0    0    0   22    0   48    0
END

COMPND    HMDB0033664
HETATM    1  N1  UNL     1      -0.804   1.859   3.037  1.00  0.00           N  
HETATM    2  C1  UNL     1      -0.765   1.046   2.032  1.00  0.00           C  
HETATM    3  N2  UNL     1       0.275   1.024   1.017  1.00  0.00           N  
HETATM    4  C2  UNL     1       0.039  -0.198   0.350  1.00  0.00           C  
HETATM    5  C3  UNL     1       0.733  -0.560  -0.877  1.00  0.00           C  
HETATM    6  C4  UNL     1       2.200  -0.789  -0.573  1.00  0.00           C  
HETATM    7  O1  UNL     1       2.827   0.407  -0.161  1.00  0.00           O  
HETATM    8  C5  UNL     1       4.175   0.382   0.160  1.00  0.00           C  
HETATM    9  O2  UNL     1       4.773  -0.720   0.063  1.00  0.00           O  
HETATM   10  N3  UNL     1       4.881   1.535   0.582  1.00  0.00           N  
HETATM   11  O3  UNL     1       6.173   1.472   0.880  1.00  0.00           O  
HETATM   12  N4  UNL     1       0.207  -1.879  -1.293  1.00  0.00           N  
HETATM   13  C6  UNL     1      -1.131  -2.258  -0.891  1.00  0.00           C  
HETATM   14  N5  UNL     1      -1.501  -3.485  -1.026  1.00  0.00           N  
HETATM   15  N6  UNL     1      -2.025  -1.299  -0.366  1.00  0.00           N  
HETATM   16  C7  UNL     1      -3.444  -1.080  -0.331  1.00  0.00           C  
HETATM   17  C8  UNL     1      -3.574   0.459  -0.414  1.00  0.00           C  
HETATM   18  C9  UNL     1      -2.108   0.950  -0.419  1.00  0.00           C  
HETATM   19  O4  UNL     1      -1.739   1.056  -1.740  1.00  0.00           O  
HETATM   20  O5  UNL     1      -2.062   2.140   0.262  1.00  0.00           O  
HETATM   21  C10 UNL     1      -1.461  -0.197   0.306  1.00  0.00           C  
HETATM   22  N7  UNL     1      -1.725   0.001   1.701  1.00  0.00           N  
HETATM   23  H1  UNL     1      -0.091   2.580   3.217  1.00  0.00           H  
HETATM   24  H2  UNL     1       0.988   1.757   0.868  1.00  0.00           H  
HETATM   25  H3  UNL     1       0.273  -1.013   1.117  1.00  0.00           H  
HETATM   26  H4  UNL     1       0.684   0.152  -1.710  1.00  0.00           H  
HETATM   27  H5  UNL     1       2.303  -1.564   0.243  1.00  0.00           H  
HETATM   28  H6  UNL     1       2.738  -1.242  -1.445  1.00  0.00           H  
HETATM   29  H7  UNL     1       4.366   2.432   0.653  1.00  0.00           H  
HETATM   30  H8  UNL     1       6.640   0.727   0.391  1.00  0.00           H  
HETATM   31  H9  UNL     1       0.836  -2.463  -1.856  1.00  0.00           H  
HETATM   32  H10 UNL     1      -0.847  -4.188  -1.418  1.00  0.00           H  
HETATM   33  H11 UNL     1      -3.820  -1.457   0.639  1.00  0.00           H  
HETATM   34  H12 UNL     1      -3.989  -1.554  -1.172  1.00  0.00           H  
HETATM   35  H13 UNL     1      -4.107   0.771  -1.311  1.00  0.00           H  
HETATM   36  H14 UNL     1      -4.087   0.775   0.517  1.00  0.00           H  
HETATM   37  H15 UNL     1      -1.319   1.941  -1.924  1.00  0.00           H  
HETATM   38  H16 UNL     1      -2.135   2.899  -0.381  1.00  0.00           H  
HETATM   39  H17 UNL     1      -2.377  -0.418   2.371  1.00  0.00           H  
CONECT    1    2    2   23
CONECT    2    3   22
CONECT    3    4   24
CONECT    4    5   21   25
CONECT    5    6   12   26
CONECT    6    7   27   28
CONECT    7    8
CONECT    8    9    9   10
CONECT   10   11   29
CONECT   11   30
CONECT   12   13   31
CONECT   13   14   14   15
CONECT   14   32
CONECT   15   16   21
CONECT   16   17   33   34
CONECT   17   18   35   36
CONECT   18   19   20   21
CONECT   19   37
CONECT   20   38
CONECT   21   22
CONECT   22   39
END

HMDB0033664
     RDKit          3D
N'-Hydroxysaxitoxin
 39 41  0  0  0  0  0  0  0  0999 V2000
   -0.8040    1.8589    3.0368 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7647    1.0464    2.0317 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2753    1.0245    1.0169 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0392   -0.1985    0.3495 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7325   -0.5596   -0.8775 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2003   -0.7889   -0.5731 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8272    0.4067   -0.1606 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.1754    0.3817    0.1595 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7733   -0.7202    0.0632 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8811    1.5349    0.5818 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.1734    1.4716    0.8801 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2067   -1.8789   -1.2926 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1314   -2.2582   -0.8906 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5012   -3.4848   -1.0259 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0255   -1.2989   -0.3656 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4445   -1.0803   -0.3315 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5744    0.4590   -0.4140 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1077    0.9498   -0.4190 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7389    1.0557   -1.7405 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0622    2.1400    0.2623 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4613   -0.1970    0.3063 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7245    0.0008    1.7006 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0905    2.5798    3.2169 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9876    1.7570    0.8684 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2731   -1.0126    1.1174 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6839    0.1522   -1.7098 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3032   -1.5637    0.2425 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7376   -1.2417   -1.4455 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3657    2.4324    0.6533 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.6403    0.7275    0.3908 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8364   -2.4629   -1.8562 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8470   -4.1883   -1.4179 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8202   -1.4570    0.6393 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9890   -1.5540   -1.1723 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1070    0.7706   -1.3107 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0873    0.7747    0.5165 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3190    1.9407   -1.9242 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1346    2.8986   -0.3812 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3774   -0.4182    2.3709 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  3
  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  2  0
  8 10  1  0
 10 11  1  0
  5 12  1  0
 12 13  1  0
 13 14  2  3
 13 15  1  0
 15 16  1  0
 16 17  1  0
 17 18  1  0
 18 19  1  0
 18 20  1  0
 18 21  1  0
 21 22  1  0
 22  2  1  0
 21  4  1  0
 21 15  1  0
  1 23  1  0
  3 24  1  0
  4 25  1  0
  5 26  1  0
  6 27  1  0
  6 28  1  0
 10 29  1  0
 11 30  1  0
 12 31  1  0
 14 32  1  0
 16 33  1  0
 16 34  1  0
 17 35  1  0
 17 36  1  0
 19 37  1  0
 20 38  1  0
 22 39  1  0
M  END

View in JSmol View NMR Assignments View Stereo Labels

Synonyms

Value	Source
({10,10-dihydroxy-2,6-diimino-decahydropyrrolo[1,2-c]purin-4-yl}methoxy)carboximidate	HMDB

Chemical Formula

C₁₀H₁₇N₇O₅

Average Molecular Weight

315.2859

Monoisotopic Molecular Weight

315.129116689

IUPAC Name

{10,10-dihydroxy-2,6-diimino-decahydropyrrolo[1,2-c]purin-4-yl}methyl N-hydroxycarbamate

Traditional Name

{10,10-dihydroxy-2,6-diimino-hexahydro-1H-pyrrolo[1,2-c]purin-4-yl}methyl N-hydroxycarbamate

CAS Registry Number

153856-77-0

SMILES

ONC(=O)OCC1NC(=N)N2CCC(O)(O)C22NC(=N)NC12

InChI Identifier

InChI=1S/C10H17N7O5/c11-6-14-5-4(3-22-8(18)16-21)13-7(12)17-2-1-9(19,20)10(5,17)15-6/h4-5,19-21H,1-3H2,(H2,12,13)(H,16,18)(H3,11,14,15)

InChI Key

AGUPJSLCNZPQMF-UHFFFAOYSA-N

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as saxitoxins, gonyautoxins, and derivatives. Saxitoxins, gonyautoxins, and derivatives are compounds with a structure based on a 2,6-diamino-4-methyl-pyrrolo[1,2-c]purin-10-ol skeleton.

Kingdom

Organic compounds

Super Class

Phenylpropanoids and polyketides

Class

Saxitoxins, gonyautoxins, and derivatives

Sub Class

Not Available

Direct Parent

Saxitoxins, gonyautoxins, and derivatives

Alternative Parents

Substituents

Saxitoxin-gonyautoxin skeleton
Imidazopyrimidine
Alkaloid or derivatives
1,3-diazinane
Imidazolidine
Pyrrolidine
Guanidine
Organoheterocyclic compound
Carboximidamide
Carbonyl hydrate
Azacycle
Organopnictogen compound
Organooxygen compound
Organonitrogen compound
Imine
Organic oxygen compound
Organic nitrogen compound
Hydrocarbon derivative
Aliphatic heteropolycyclic compound

Molecular Framework

Aliphatic heteropolycyclic compounds

External Descriptors

Not Available

Ontology

Physiological effect

Not Available

Disposition

Biological location

Cellular substructure

Extracellular (HMDB: HMDB0033664)
Cytoplasm (HMDB: HMDB0033664)

Source

Exogenous

Food

Food (HMDB: HMDB0033664)

Endogenous

Plant

Plant (HMDB: HMDB0033664)

Not Available

Nutrient (HMDB: HMDB0033664)

Environmental role

Environmental contaminant (HMDB: HMDB0033664)

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
Water Solubility	2.8 g/L	ALOGPS
logP	-2.3	ALOGPS
logP	-3	ChemAxon
logS	-2	ALOGPS
pKa (Strongest Acidic)	8.3	ChemAxon
pKa (Strongest Basic)	10.43	ChemAxon
Physiological Charge	2	ChemAxon
Hydrogen Acceptor Count	10	ChemAxon
Hydrogen Donor Count	9	ChemAxon
Polar Surface Area	186.05 Å²	ChemAxon
Rotatable Bond Count	3	ChemAxon
Refractivity	90.19 m³·mol⁻¹	ChemAxon
Polarizability	28.81 Å³	ChemAxon
Number of Rings	3	ChemAxon
Bioavailability	Yes	ChemAxon
Rule of Five	No	ChemAxon
Ghose Filter	No	ChemAxon
Veber's Rule	No	ChemAxon
MDDR-like Rule	No	ChemAxon

Predicted Chromatographic Properties

Predicted Collision Cross Sections

Predictor	Adduct Type	CCS Value (Å²)	Reference
DarkChem	[M+H]+	169.052	31661259
DarkChem	[M-H]-	168.48	31661259
DeepCCS	[M-2H]-	202.974	30932474
DeepCCS	[M+Na]+	178.54	30932474
AllCCS	[M+H]+	169.4	32859911
AllCCS	[M+H-H2O]+	166.2	32859911
AllCCS	[M+NH4]+	172.3	32859911
AllCCS	[M+Na]+	173.2	32859911
AllCCS	[M-H]-	169.7	32859911
AllCCS	[M+Na-2H]-	169.2	32859911
AllCCS	[M+HCOO]-	168.7	32859911

Predicted Kovats Retention Indices

Underivatized

Metabolite	SMILES	Kovats RI Value	Column Type	Reference
N'-Hydroxysaxitoxin	ONC(=O)OCC1NC(=N)N2CCC(O)(O)C22NC(=N)NC12	5409.0	Standard polar	33892256
N'-Hydroxysaxitoxin	ONC(=O)OCC1NC(=N)N2CCC(O)(O)C22NC(=N)NC12	3194.5	Standard non polar	33892256
N'-Hydroxysaxitoxin	ONC(=O)OCC1NC(=N)N2CCC(O)(O)C22NC(=N)NC12	3645.0	Semi standard non polar	33892256

Derivatized

Derivative Name / Structure	SMILES	Kovats RI Value	Column Type	Reference
N'-Hydroxysaxitoxin,1TMS,isomer #1	C[Si](C)(C)OC1(O)CCN2C(=N)NC(COC(=O)NO)C3NC(=N)NC321	3472.7	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,1TMS,isomer #2	C[Si](C)(C)N(O)C(=O)OCC1NC(=N)N2CCC(O)(O)C23NC(=N)NC13	3445.8	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,1TMS,isomer #3	C[Si](C)(C)N1C(=N)N2CCC(O)(O)C23NC(=N)NC3C1COC(=O)NO	3421.2	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,1TMS,isomer #4	C[Si](C)(C)N=C1NC(COC(=O)NO)C2NC(=N)NC23N1CCC3(O)O	3453.9	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,1TMS,isomer #5	C[Si](C)(C)N1C(=N)NC2C(COC(=O)NO)NC(=N)N3CCC(O)(O)C231	3402.9	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,1TMS,isomer #6	C[Si](C)(C)N=C1NC2C(COC(=O)NO)NC(=N)N3CCC(O)(O)C23N1	3486.5	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,1TMS,isomer #7	C[Si](C)(C)N1C(=N)NC23C1C(COC(=O)NO)NC(=N)N2CCC3(O)O	3390.9	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,2TMS,isomer #1	C[Si](C)(C)OC1(O[Si](C)(C)C)CCN2C(=N)NC(COC(=O)NO)C3NC(=N)NC321	3426.4	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,2TMS,isomer #10	C[Si](C)(C)N(O)C(=O)OCC1NC(=N)N2CCC(O)(O)C23C1NC(=N)N3[Si](C)(C)C	3344.6	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,2TMS,isomer #11	C[Si](C)(C)N=C1NC2C(COC(=O)N(O)[Si](C)(C)C)NC(=N)N3CCC(O)(O)C23N1	3424.2	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,2TMS,isomer #12	C[Si](C)(C)N(O)C(=O)OCC1NC(=N)N2CCC(O)(O)C23NC(=N)N([Si](C)(C)C)C13	3336.7	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,2TMS,isomer #13	C[Si](C)(C)N=C1N2CCC(O)(O)C23NC(=N)NC3C(COC(=O)NO)N1[Si](C)(C)C	3352.6	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,2TMS,isomer #14	C[Si](C)(C)N1C(=N)N2CCC(O)(O)C23C(NC(=N)N3[Si](C)(C)C)C1COC(=O)NO	3342.1	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,2TMS,isomer #15	C[Si](C)(C)N=C1NC2C(COC(=O)NO)N([Si](C)(C)C)C(=N)N3CCC(O)(O)C23N1	3378.4	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,2TMS,isomer #16	C[Si](C)(C)N1C(=N)N2CCC(O)(O)C23NC(=N)N([Si](C)(C)C)C3C1COC(=O)NO	3306.2	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,2TMS,isomer #17	C[Si](C)(C)N=C1NC(COC(=O)NO)C2N([Si](C)(C)C)C(=N)NC23N1CCC3(O)O	3324.5	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,2TMS,isomer #18	C[Si](C)(C)N=C1NC2C(COC(=O)NO)NC(=N[Si](C)(C)C)N3CCC(O)(O)C23N1	3393.9	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,2TMS,isomer #19	C[Si](C)(C)N=C1NC(COC(=O)NO)C2NC(=N)N([Si](C)(C)C)C23N1CCC3(O)O	3331.3	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,2TMS,isomer #2	C[Si](C)(C)N=C1NC(COC(=O)NO)C2NC(=N)NC23N1CCC3(O)O[Si](C)(C)C	3408.4	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,2TMS,isomer #20	C[Si](C)(C)N=C1NC2C(COC(=O)NO)NC(=N)N3CCC(O)(O)C23N1[Si](C)(C)C	3321.3	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,2TMS,isomer #21	C[Si](C)(C)N1C(=N)N([Si](C)(C)C)C23C1C(COC(=O)NO)NC(=N)N2CCC3(O)O	3216.0	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,2TMS,isomer #22	C[Si](C)(C)N=C1NC23C(C(COC(=O)NO)NC(=N)N2CCC3(O)O)N1[Si](C)(C)C	3304.7	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,2TMS,isomer #3	C[Si](C)(C)OC1(O)CCN2C(=N)N([Si](C)(C)C)C(COC(=O)NO)C3NC(=N)NC321	3366.2	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,2TMS,isomer #4	C[Si](C)(C)OC1(O)CCN2C(=N)NC(COC(=O)N(O)[Si](C)(C)C)C3NC(=N)NC321	3418.9	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,2TMS,isomer #5	C[Si](C)(C)OC1(O)CCN2C(=N)NC(COC(=O)NO)C3N([Si](C)(C)C)C(=N)NC321	3386.9	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,2TMS,isomer #6	C[Si](C)(C)N=C1NC2C(COC(=O)NO)NC(=N)N3CCC(O)(O[Si](C)(C)C)C23N1	3440.9	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,2TMS,isomer #7	C[Si](C)(C)OC1(O)CCN2C(=N)NC(COC(=O)NO)C3NC(=N)N([Si](C)(C)C)C321	3401.5	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,2TMS,isomer #8	C[Si](C)(C)N(O)C(=O)OCC1C2NC(=N)NC23N(CCC3(O)O)C(=N)N1[Si](C)(C)C	3354.9	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,2TMS,isomer #9	C[Si](C)(C)N=C1NC(COC(=O)N(O)[Si](C)(C)C)C2NC(=N)NC23N1CCC3(O)O	3361.9	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #1	C[Si](C)(C)N=C1NC(COC(=O)NO)C2NC(=N)NC23N1CCC3(O[Si](C)(C)C)O[Si](C)(C)C	3349.3	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #1	C[Si](C)(C)N=C1NC(COC(=O)NO)C2NC(=N)NC23N1CCC3(O[Si](C)(C)C)O[Si](C)(C)C	2827.5	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #10	C[Si](C)(C)N=C1NC2C(COC(=O)NO)NC(=N[Si](C)(C)C)N3CCC(O)(O[Si](C)(C)C)C23N1	3343.1	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #10	C[Si](C)(C)N=C1NC2C(COC(=O)NO)NC(=N[Si](C)(C)C)N3CCC(O)(O[Si](C)(C)C)C23N1	2859.1	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #11	C[Si](C)(C)N=C1NC(COC(=O)NO)C2NC(=N)N([Si](C)(C)C)C23N1CCC3(O)O[Si](C)(C)C	3319.5	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #11	C[Si](C)(C)N=C1NC(COC(=O)NO)C2NC(=N)N([Si](C)(C)C)C23N1CCC3(O)O[Si](C)(C)C	2968.9	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #12	C[Si](C)(C)OC1(O)CCN2C(=N)N([Si](C)(C)C)C(COC(=O)N(O)[Si](C)(C)C)C3NC(=N)NC321	3279.9	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #12	C[Si](C)(C)OC1(O)CCN2C(=N)N([Si](C)(C)C)C(COC(=O)N(O)[Si](C)(C)C)C3NC(=N)NC321	2932.8	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #13	C[Si](C)(C)OC1(O)CCN2C(=N)N([Si](C)(C)C)C(COC(=O)NO)C3N([Si](C)(C)C)C(=N)NC321	3264.3	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #13	C[Si](C)(C)OC1(O)CCN2C(=N)N([Si](C)(C)C)C(COC(=O)NO)C3N([Si](C)(C)C)C(=N)NC321	3007.9	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #14	C[Si](C)(C)N=C1NC2C(COC(=O)NO)N([Si](C)(C)C)C(=N)N3CCC(O)(O[Si](C)(C)C)C23N1	3331.7	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #14	C[Si](C)(C)N=C1NC2C(COC(=O)NO)N([Si](C)(C)C)C(=N)N3CCC(O)(O[Si](C)(C)C)C23N1	2973.7	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #15	C[Si](C)(C)OC1(O)CCN2C(=N)N([Si](C)(C)C)C(COC(=O)NO)C3NC(=N)N([Si](C)(C)C)C321	3313.3	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #15	C[Si](C)(C)OC1(O)CCN2C(=N)N([Si](C)(C)C)C(COC(=O)NO)C3NC(=N)N([Si](C)(C)C)C321	3044.7	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #16	C[Si](C)(C)OC1(O)CCN2C(=N)NC(COC(=O)N(O)[Si](C)(C)C)C3N([Si](C)(C)C)C(=N)NC321	3272.1	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #16	C[Si](C)(C)OC1(O)CCN2C(=N)NC(COC(=O)N(O)[Si](C)(C)C)C3N([Si](C)(C)C)C(=N)NC321	2954.6	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #17	C[Si](C)(C)N=C1NC2C(COC(=O)N(O)[Si](C)(C)C)NC(=N)N3CCC(O)(O[Si](C)(C)C)C23N1	3364.2	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #17	C[Si](C)(C)N=C1NC2C(COC(=O)N(O)[Si](C)(C)C)NC(=N)N3CCC(O)(O[Si](C)(C)C)C23N1	2914.7	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #18	C[Si](C)(C)OC1(O)CCN2C(=N)NC(COC(=O)N(O)[Si](C)(C)C)C3NC(=N)N([Si](C)(C)C)C321	3321.1	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #18	C[Si](C)(C)OC1(O)CCN2C(=N)NC(COC(=O)N(O)[Si](C)(C)C)C3NC(=N)N([Si](C)(C)C)C321	2973.1	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #19	C[Si](C)(C)N=C1NC23C(C(COC(=O)NO)NC(=N)N2CCC3(O)O[Si](C)(C)C)N1[Si](C)(C)C	3299.0	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #19	C[Si](C)(C)N=C1NC23C(C(COC(=O)NO)NC(=N)N2CCC3(O)O[Si](C)(C)C)N1[Si](C)(C)C	2943.4	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #2	C[Si](C)(C)OC1(O[Si](C)(C)C)CCN2C(=N)N([Si](C)(C)C)C(COC(=O)NO)C3NC(=N)NC321	3310.9	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #2	C[Si](C)(C)OC1(O[Si](C)(C)C)CCN2C(=N)N([Si](C)(C)C)C(COC(=O)NO)C3NC(=N)NC321	2903.9	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #20	C[Si](C)(C)OC1(O)CCN2C(=N)NC(COC(=O)NO)C3N([Si](C)(C)C)C(=N)N([Si](C)(C)C)C321	3204.0	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #20	C[Si](C)(C)OC1(O)CCN2C(=N)NC(COC(=O)NO)C3N([Si](C)(C)C)C(=N)N([Si](C)(C)C)C321	3005.6	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #21	C[Si](C)(C)N=C1NC2C(COC(=O)NO)NC(=N)N3CCC(O)(O[Si](C)(C)C)C23N1[Si](C)(C)C	3326.4	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #21	C[Si](C)(C)N=C1NC2C(COC(=O)NO)NC(=N)N3CCC(O)(O[Si](C)(C)C)C23N1[Si](C)(C)C	2966.0	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #22	C[Si](C)(C)N(O)C(=O)OCC1C2N([Si](C)(C)C)C(=N)NC23N(CCC3(O)O)C(=N)N1[Si](C)(C)C	3229.2	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #22	C[Si](C)(C)N(O)C(=O)OCC1C2N([Si](C)(C)C)C(=N)NC23N(CCC3(O)O)C(=N)N1[Si](C)(C)C	3016.4	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #23	C[Si](C)(C)N=C1NC2C(COC(=O)N(O)[Si](C)(C)C)N([Si](C)(C)C)C(=N)N3CCC(O)(O)C23N1	3299.2	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #23	C[Si](C)(C)N=C1NC2C(COC(=O)N(O)[Si](C)(C)C)N([Si](C)(C)C)C(=N)N3CCC(O)(O)C23N1	2997.9	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #24	C[Si](C)(C)N(O)C(=O)OCC1C2NC(=N)N([Si](C)(C)C)C23N(CCC3(O)O)C(=N)N1[Si](C)(C)C	3249.8	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #24	C[Si](C)(C)N(O)C(=O)OCC1C2NC(=N)N([Si](C)(C)C)C23N(CCC3(O)O)C(=N)N1[Si](C)(C)C	3033.6	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #25	C[Si](C)(C)N=C1N2CCC(O)(O)C23NC(=N)NC3C(COC(=O)N(O)[Si](C)(C)C)N1[Si](C)(C)C	3250.8	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #25	C[Si](C)(C)N=C1N2CCC(O)(O)C23NC(=N)NC3C(COC(=O)N(O)[Si](C)(C)C)N1[Si](C)(C)C	2875.5	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #26	C[Si](C)(C)N=C1NC(COC(=O)N(O)[Si](C)(C)C)C2N([Si](C)(C)C)C(=N)NC23N1CCC3(O)O	3212.4	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #26	C[Si](C)(C)N=C1NC(COC(=O)N(O)[Si](C)(C)C)C2N([Si](C)(C)C)C(=N)NC23N1CCC3(O)O	2997.1	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #27	C[Si](C)(C)N=C1NC2C(COC(=O)N(O)[Si](C)(C)C)NC(=N[Si](C)(C)C)N3CCC(O)(O)C23N1	3293.3	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #27	C[Si](C)(C)N=C1NC2C(COC(=O)N(O)[Si](C)(C)C)NC(=N[Si](C)(C)C)N3CCC(O)(O)C23N1	2937.2	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #28	C[Si](C)(C)N=C1NC(COC(=O)N(O)[Si](C)(C)C)C2NC(=N)N([Si](C)(C)C)C23N1CCC3(O)O	3223.4	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #28	C[Si](C)(C)N=C1NC(COC(=O)N(O)[Si](C)(C)C)C2NC(=N)N([Si](C)(C)C)C23N1CCC3(O)O	3010.2	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #29	C[Si](C)(C)N(O)C(=O)OCC1NC(=N)N2CCC(O)(O)C23C1N([Si](C)(C)C)C(=N)N3[Si](C)(C)C	3118.3	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #29	C[Si](C)(C)N(O)C(=O)OCC1NC(=N)N2CCC(O)(O)C23C1N([Si](C)(C)C)C(=N)N3[Si](C)(C)C	3003.6	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #3	C[Si](C)(C)OC1(O[Si](C)(C)C)CCN2C(=N)NC(COC(=O)N(O)[Si](C)(C)C)C3NC(=N)NC321	3362.2	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #3	C[Si](C)(C)OC1(O[Si](C)(C)C)CCN2C(=N)NC(COC(=O)N(O)[Si](C)(C)C)C3NC(=N)NC321	2851.5	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #30	C[Si](C)(C)N=C1NC2C(COC(=O)N(O)[Si](C)(C)C)NC(=N)N3CCC(O)(O)C23N1[Si](C)(C)C	3235.0	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #30	C[Si](C)(C)N=C1NC2C(COC(=O)N(O)[Si](C)(C)C)NC(=N)N3CCC(O)(O)C23N1[Si](C)(C)C	2985.7	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #31	C[Si](C)(C)N=C1NC23C(C(COC(=O)N(O)[Si](C)(C)C)NC(=N)N2CCC3(O)O)N1[Si](C)(C)C	3225.3	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #31	C[Si](C)(C)N=C1NC23C(C(COC(=O)N(O)[Si](C)(C)C)NC(=N)N2CCC3(O)O)N1[Si](C)(C)C	2989.9	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #32	C[Si](C)(C)N=C1N2CCC(O)(O)C23C(NC(=N)N3[Si](C)(C)C)C(COC(=O)NO)N1[Si](C)(C)C	3229.0	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #32	C[Si](C)(C)N=C1N2CCC(O)(O)C23C(NC(=N)N3[Si](C)(C)C)C(COC(=O)NO)N1[Si](C)(C)C	2965.1	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #33	C[Si](C)(C)N=C1NC2C(COC(=O)NO)N([Si](C)(C)C)C(=N[Si](C)(C)C)N3CCC(O)(O)C23N1	3288.1	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #33	C[Si](C)(C)N=C1NC2C(COC(=O)NO)N([Si](C)(C)C)C(=N[Si](C)(C)C)N3CCC(O)(O)C23N1	2886.1	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #34	C[Si](C)(C)N=C1N2CCC(O)(O)C23NC(=N)N([Si](C)(C)C)C3C(COC(=O)NO)N1[Si](C)(C)C	3217.4	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #34	C[Si](C)(C)N=C1N2CCC(O)(O)C23NC(=N)N([Si](C)(C)C)C3C(COC(=O)NO)N1[Si](C)(C)C	2951.4	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #35	C[Si](C)(C)N1C(=N)N2CCC(O)(O)C23C(C1COC(=O)NO)N([Si](C)(C)C)C(=N)N3[Si](C)(C)C	3121.5	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #35	C[Si](C)(C)N1C(=N)N2CCC(O)(O)C23C(C1COC(=O)NO)N([Si](C)(C)C)C(=N)N3[Si](C)(C)C	3061.0	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #36	C[Si](C)(C)N=C1NC2C(COC(=O)NO)N([Si](C)(C)C)C(=N)N3CCC(O)(O)C23N1[Si](C)(C)C	3263.9	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #36	C[Si](C)(C)N=C1NC2C(COC(=O)NO)N([Si](C)(C)C)C(=N)N3CCC(O)(O)C23N1[Si](C)(C)C	3043.9	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #37	C[Si](C)(C)N=C1NC23C(C(COC(=O)NO)N([Si](C)(C)C)C(=N)N2CCC3(O)O)N1[Si](C)(C)C	3224.9	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #37	C[Si](C)(C)N=C1NC23C(C(COC(=O)NO)N([Si](C)(C)C)C(=N)N2CCC3(O)O)N1[Si](C)(C)C	3034.8	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #38	C[Si](C)(C)N=C1NC(COC(=O)NO)C2N([Si](C)(C)C)C(=N[Si](C)(C)C)NC23N1CCC3(O)O	3241.4	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #38	C[Si](C)(C)N=C1NC(COC(=O)NO)C2N([Si](C)(C)C)C(=N[Si](C)(C)C)NC23N1CCC3(O)O	2938.1	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #39	C[Si](C)(C)N=C1NC(COC(=O)NO)C2N([Si](C)(C)C)C(=N)N([Si](C)(C)C)C23N1CCC3(O)O	3105.1	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #39	C[Si](C)(C)N=C1NC(COC(=O)NO)C2N([Si](C)(C)C)C(=N)N([Si](C)(C)C)C23N1CCC3(O)O	3015.6	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #4	C[Si](C)(C)OC1(O[Si](C)(C)C)CCN2C(=N)NC(COC(=O)NO)C3N([Si](C)(C)C)C(=N)NC321	3337.5	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #4	C[Si](C)(C)OC1(O[Si](C)(C)C)CCN2C(=N)NC(COC(=O)NO)C3N([Si](C)(C)C)C(=N)NC321	2920.5	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #40	C[Si](C)(C)N=C1NC(COC(=O)NO)C2NC(=N[Si](C)(C)C)N([Si](C)(C)C)C23N1CCC3(O)O	3240.3	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #40	C[Si](C)(C)N=C1NC(COC(=O)NO)C2NC(=N[Si](C)(C)C)N([Si](C)(C)C)C23N1CCC3(O)O	2968.3	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #41	C[Si](C)(C)N=C1N([Si](C)(C)C)C2C(COC(=O)NO)NC(=N)N3CCC(O)(O)C23N1[Si](C)(C)C	3133.9	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #41	C[Si](C)(C)N=C1N([Si](C)(C)C)C2C(COC(=O)NO)NC(=N)N3CCC(O)(O)C23N1[Si](C)(C)C	2875.8	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #5	C[Si](C)(C)N=C1NC2C(COC(=O)NO)NC(=N)N3CCC(O[Si](C)(C)C)(O[Si](C)(C)C)C23N1	3381.7	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #5	C[Si](C)(C)N=C1NC2C(COC(=O)NO)NC(=N)N3CCC(O[Si](C)(C)C)(O[Si](C)(C)C)C23N1	2876.7	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #6	C[Si](C)(C)OC1(O[Si](C)(C)C)CCN2C(=N)NC(COC(=O)NO)C3NC(=N)N([Si](C)(C)C)C321	3371.3	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #6	C[Si](C)(C)OC1(O[Si](C)(C)C)CCN2C(=N)NC(COC(=O)NO)C3NC(=N)N([Si](C)(C)C)C321	2941.0	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #7	C[Si](C)(C)N=C1N2CCC(O)(O[Si](C)(C)C)C23NC(=N)NC3C(COC(=O)NO)N1[Si](C)(C)C	3289.1	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #7	C[Si](C)(C)N=C1N2CCC(O)(O[Si](C)(C)C)C23NC(=N)NC3C(COC(=O)NO)N1[Si](C)(C)C	2831.7	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #8	C[Si](C)(C)N=C1NC(COC(=O)N(O)[Si](C)(C)C)C2NC(=N)NC23N1CCC3(O)O[Si](C)(C)C	3311.3	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #8	C[Si](C)(C)N=C1NC(COC(=O)N(O)[Si](C)(C)C)C2NC(=N)NC23N1CCC3(O)O[Si](C)(C)C	2868.2	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #9	C[Si](C)(C)N=C1NC(COC(=O)NO)C2N([Si](C)(C)C)C(=N)NC23N1CCC3(O)O[Si](C)(C)C	3296.3	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TMS,isomer #9	C[Si](C)(C)N=C1NC(COC(=O)NO)C2N([Si](C)(C)C)C(=N)NC23N1CCC3(O)O[Si](C)(C)C	2938.2	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #1	C[Si](C)(C)N=C1N2CCC(O[Si](C)(C)C)(O[Si](C)(C)C)C23NC(=N)NC3C(COC(=O)NO)N1[Si](C)(C)C	3209.9	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #1	C[Si](C)(C)N=C1N2CCC(O[Si](C)(C)C)(O[Si](C)(C)C)C23NC(=N)NC3C(COC(=O)NO)N1[Si](C)(C)C	2823.2	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #10	C[Si](C)(C)OC1(O[Si](C)(C)C)CCN2C(=N)NC(COC(=O)N(O)[Si](C)(C)C)C3N([Si](C)(C)C)C(=N)NC321	3236.6	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #10	C[Si](C)(C)OC1(O[Si](C)(C)C)CCN2C(=N)NC(COC(=O)N(O)[Si](C)(C)C)C3N([Si](C)(C)C)C(=N)NC321	2974.3	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #11	C[Si](C)(C)N=C1NC2C(COC(=O)N(O)[Si](C)(C)C)NC(=N)N3CCC(O[Si](C)(C)C)(O[Si](C)(C)C)C23N1	3288.3	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #11	C[Si](C)(C)N=C1NC2C(COC(=O)N(O)[Si](C)(C)C)NC(=N)N3CCC(O[Si](C)(C)C)(O[Si](C)(C)C)C23N1	2908.1	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #12	C[Si](C)(C)OC1(O[Si](C)(C)C)CCN2C(=N)NC(COC(=O)N(O)[Si](C)(C)C)C3NC(=N)N([Si](C)(C)C)C321	3263.6	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #12	C[Si](C)(C)OC1(O[Si](C)(C)C)CCN2C(=N)NC(COC(=O)N(O)[Si](C)(C)C)C3NC(=N)N([Si](C)(C)C)C321	2992.8	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #13	C[Si](C)(C)N=C1NC23C(C(COC(=O)NO)NC(=N)N2CCC3(O[Si](C)(C)C)O[Si](C)(C)C)N1[Si](C)(C)C	3255.8	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #13	C[Si](C)(C)N=C1NC23C(C(COC(=O)NO)NC(=N)N2CCC3(O[Si](C)(C)C)O[Si](C)(C)C)N1[Si](C)(C)C	2951.4	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #14	C[Si](C)(C)OC1(O[Si](C)(C)C)CCN2C(=N)NC(COC(=O)NO)C3N([Si](C)(C)C)C(=N)N([Si](C)(C)C)C321	3184.9	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #14	C[Si](C)(C)OC1(O[Si](C)(C)C)CCN2C(=N)NC(COC(=O)NO)C3N([Si](C)(C)C)C(=N)N([Si](C)(C)C)C321	3040.3	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #15	C[Si](C)(C)N=C1NC2C(COC(=O)NO)NC(=N)N3CCC(O[Si](C)(C)C)(O[Si](C)(C)C)C23N1[Si](C)(C)C	3275.0	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #15	C[Si](C)(C)N=C1NC2C(COC(=O)NO)NC(=N)N3CCC(O[Si](C)(C)C)(O[Si](C)(C)C)C23N1[Si](C)(C)C	2959.0	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #16	C[Si](C)(C)N=C1N2CCC(O)(O[Si](C)(C)C)C23C(NC(=N)N3[Si](C)(C)C)C(COC(=O)NO)N1[Si](C)(C)C	3196.4	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #16	C[Si](C)(C)N=C1N2CCC(O)(O[Si](C)(C)C)C23C(NC(=N)N3[Si](C)(C)C)C(COC(=O)NO)N1[Si](C)(C)C	2984.3	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #17	C[Si](C)(C)N=C1NC2C(COC(=O)NO)N([Si](C)(C)C)C(=N[Si](C)(C)C)N3CCC(O)(O[Si](C)(C)C)C23N1	3229.4	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #17	C[Si](C)(C)N=C1NC2C(COC(=O)NO)N([Si](C)(C)C)C(=N[Si](C)(C)C)N3CCC(O)(O[Si](C)(C)C)C23N1	2883.5	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #18	C[Si](C)(C)N=C1N2CCC(O)(O[Si](C)(C)C)C23NC(=N)N([Si](C)(C)C)C3C(COC(=O)NO)N1[Si](C)(C)C	3178.6	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #18	C[Si](C)(C)N=C1N2CCC(O)(O[Si](C)(C)C)C23NC(=N)N([Si](C)(C)C)C3C(COC(=O)NO)N1[Si](C)(C)C	2959.7	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #19	C[Si](C)(C)N=C1N2CCC(O)(O[Si](C)(C)C)C23NC(=N)NC3C(COC(=O)N(O)[Si](C)(C)C)N1[Si](C)(C)C	3174.6	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #19	C[Si](C)(C)N=C1N2CCC(O)(O[Si](C)(C)C)C23NC(=N)NC3C(COC(=O)N(O)[Si](C)(C)C)N1[Si](C)(C)C	2858.2	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #2	C[Si](C)(C)N=C1NC(COC(=O)N(O)[Si](C)(C)C)C2NC(=N)NC23N1CCC3(O[Si](C)(C)C)O[Si](C)(C)C	3243.2	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #2	C[Si](C)(C)N=C1NC(COC(=O)N(O)[Si](C)(C)C)C2NC(=N)NC23N1CCC3(O[Si](C)(C)C)O[Si](C)(C)C	2864.0	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #20	C[Si](C)(C)N=C1NC(COC(=O)N(O)[Si](C)(C)C)C2N([Si](C)(C)C)C(=N)NC23N1CCC3(O)O[Si](C)(C)C	3156.9	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #20	C[Si](C)(C)N=C1NC(COC(=O)N(O)[Si](C)(C)C)C2N([Si](C)(C)C)C(=N)NC23N1CCC3(O)O[Si](C)(C)C	2990.2	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #21	C[Si](C)(C)N=C1NC2C(COC(=O)N(O)[Si](C)(C)C)NC(=N[Si](C)(C)C)N3CCC(O)(O[Si](C)(C)C)C23N1	3237.5	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #21	C[Si](C)(C)N=C1NC2C(COC(=O)N(O)[Si](C)(C)C)NC(=N[Si](C)(C)C)N3CCC(O)(O[Si](C)(C)C)C23N1	2910.6	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #22	C[Si](C)(C)N=C1NC(COC(=O)N(O)[Si](C)(C)C)C2NC(=N)N([Si](C)(C)C)C23N1CCC3(O)O[Si](C)(C)C	3185.6	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #22	C[Si](C)(C)N=C1NC(COC(=O)N(O)[Si](C)(C)C)C2NC(=N)N([Si](C)(C)C)C23N1CCC3(O)O[Si](C)(C)C	3002.9	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #23	C[Si](C)(C)N=C1NC(COC(=O)NO)C2N([Si](C)(C)C)C(=N[Si](C)(C)C)NC23N1CCC3(O)O[Si](C)(C)C	3212.0	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #23	C[Si](C)(C)N=C1NC(COC(=O)NO)C2N([Si](C)(C)C)C(=N[Si](C)(C)C)NC23N1CCC3(O)O[Si](C)(C)C	2937.5	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #24	C[Si](C)(C)N=C1NC(COC(=O)NO)C2N([Si](C)(C)C)C(=N)N([Si](C)(C)C)C23N1CCC3(O)O[Si](C)(C)C	3096.3	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #24	C[Si](C)(C)N=C1NC(COC(=O)NO)C2N([Si](C)(C)C)C(=N)N([Si](C)(C)C)C23N1CCC3(O)O[Si](C)(C)C	3052.9	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #25	C[Si](C)(C)N=C1NC(COC(=O)NO)C2NC(=N[Si](C)(C)C)N([Si](C)(C)C)C23N1CCC3(O)O[Si](C)(C)C	3221.6	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #25	C[Si](C)(C)N=C1NC(COC(=O)NO)C2NC(=N[Si](C)(C)C)N([Si](C)(C)C)C23N1CCC3(O)O[Si](C)(C)C	2974.9	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #26	C[Si](C)(C)OC1(O)CCN2C(=N)N([Si](C)(C)C)C(COC(=O)N(O)[Si](C)(C)C)C3N([Si](C)(C)C)C(=N)NC321	3190.6	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #26	C[Si](C)(C)OC1(O)CCN2C(=N)N([Si](C)(C)C)C(COC(=O)N(O)[Si](C)(C)C)C3N([Si](C)(C)C)C(=N)NC321	3063.6	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #27	C[Si](C)(C)N=C1NC2C(COC(=O)N(O)[Si](C)(C)C)N([Si](C)(C)C)C(=N)N3CCC(O)(O[Si](C)(C)C)C23N1	3235.9	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #27	C[Si](C)(C)N=C1NC2C(COC(=O)N(O)[Si](C)(C)C)N([Si](C)(C)C)C(=N)N3CCC(O)(O[Si](C)(C)C)C23N1	2996.1	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #28	C[Si](C)(C)OC1(O)CCN2C(=N)N([Si](C)(C)C)C(COC(=O)N(O)[Si](C)(C)C)C3NC(=N)N([Si](C)(C)C)C321	3208.9	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #28	C[Si](C)(C)OC1(O)CCN2C(=N)N([Si](C)(C)C)C(COC(=O)N(O)[Si](C)(C)C)C3NC(=N)N([Si](C)(C)C)C321	3094.9	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #29	C[Si](C)(C)N=C1NC23C(C(COC(=O)NO)N([Si](C)(C)C)C(=N)N2CCC3(O)O[Si](C)(C)C)N1[Si](C)(C)C	3187.6	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #29	C[Si](C)(C)N=C1NC23C(C(COC(=O)NO)N([Si](C)(C)C)C(=N)N2CCC3(O)O[Si](C)(C)C)N1[Si](C)(C)C	3043.2	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #3	C[Si](C)(C)N=C1NC(COC(=O)NO)C2N([Si](C)(C)C)C(=N)NC23N1CCC3(O[Si](C)(C)C)O[Si](C)(C)C	3230.5	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #3	C[Si](C)(C)N=C1NC(COC(=O)NO)C2N([Si](C)(C)C)C(=N)NC23N1CCC3(O[Si](C)(C)C)O[Si](C)(C)C	2953.8	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #30	C[Si](C)(C)OC1(O)CCN2C(=N)N([Si](C)(C)C)C(COC(=O)NO)C3N([Si](C)(C)C)C(=N)N([Si](C)(C)C)C321	3134.4	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #30	C[Si](C)(C)OC1(O)CCN2C(=N)N([Si](C)(C)C)C(COC(=O)NO)C3N([Si](C)(C)C)C(=N)N([Si](C)(C)C)C321	3132.8	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #31	C[Si](C)(C)N=C1NC2C(COC(=O)NO)N([Si](C)(C)C)C(=N)N3CCC(O)(O[Si](C)(C)C)C23N1[Si](C)(C)C	3219.8	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #31	C[Si](C)(C)N=C1NC2C(COC(=O)NO)N([Si](C)(C)C)C(=N)N3CCC(O)(O[Si](C)(C)C)C23N1[Si](C)(C)C	3081.7	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #32	C[Si](C)(C)N=C1NC23C(C(COC(=O)N(O)[Si](C)(C)C)NC(=N)N2CCC3(O)O[Si](C)(C)C)N1[Si](C)(C)C	3180.7	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #32	C[Si](C)(C)N=C1NC23C(C(COC(=O)N(O)[Si](C)(C)C)NC(=N)N2CCC3(O)O[Si](C)(C)C)N1[Si](C)(C)C	2980.2	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #33	C[Si](C)(C)OC1(O)CCN2C(=N)NC(COC(=O)N(O)[Si](C)(C)C)C3N([Si](C)(C)C)C(=N)N([Si](C)(C)C)C321	3122.1	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #33	C[Si](C)(C)OC1(O)CCN2C(=N)NC(COC(=O)N(O)[Si](C)(C)C)C3N([Si](C)(C)C)C(=N)N([Si](C)(C)C)C321	3063.4	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #34	C[Si](C)(C)N=C1NC2C(COC(=O)N(O)[Si](C)(C)C)NC(=N)N3CCC(O)(O[Si](C)(C)C)C23N1[Si](C)(C)C	3194.8	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #34	C[Si](C)(C)N=C1NC2C(COC(=O)N(O)[Si](C)(C)C)NC(=N)N3CCC(O)(O[Si](C)(C)C)C23N1[Si](C)(C)C	2992.7	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #35	C[Si](C)(C)N=C1N([Si](C)(C)C)C2C(COC(=O)NO)NC(=N)N3CCC(O)(O[Si](C)(C)C)C23N1[Si](C)(C)C	3126.3	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #35	C[Si](C)(C)N=C1N([Si](C)(C)C)C2C(COC(=O)NO)NC(=N)N3CCC(O)(O[Si](C)(C)C)C23N1[Si](C)(C)C	2882.2	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #36	C[Si](C)(C)N=C1NC23C(C(COC(=O)N(O)[Si](C)(C)C)N([Si](C)(C)C)C(=N)N2CCC3(O)O)N1[Si](C)(C)C	3153.7	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #36	C[Si](C)(C)N=C1NC23C(C(COC(=O)N(O)[Si](C)(C)C)N([Si](C)(C)C)C(=N)N2CCC3(O)O)N1[Si](C)(C)C	3071.9	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #37	C[Si](C)(C)N(O)C(=O)OCC1C2N([Si](C)(C)C)C(=N)N([Si](C)(C)C)C23N(CCC3(O)O)C(=N)N1[Si](C)(C)C	3074.2	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #37	C[Si](C)(C)N(O)C(=O)OCC1C2N([Si](C)(C)C)C(=N)N([Si](C)(C)C)C23N(CCC3(O)O)C(=N)N1[Si](C)(C)C	3130.2	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #38	C[Si](C)(C)N=C1N2CCC(O)(O)C23NC(=N)N([Si](C)(C)C)C3C(COC(=O)N(O)[Si](C)(C)C)N1[Si](C)(C)C	3126.3	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #38	C[Si](C)(C)N=C1N2CCC(O)(O)C23NC(=N)N([Si](C)(C)C)C3C(COC(=O)N(O)[Si](C)(C)C)N1[Si](C)(C)C	3008.3	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #39	C[Si](C)(C)N=C1NC2C(COC(=O)N(O)[Si](C)(C)C)N([Si](C)(C)C)C(=N[Si](C)(C)C)N3CCC(O)(O)C23N1	3189.9	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #39	C[Si](C)(C)N=C1NC2C(COC(=O)N(O)[Si](C)(C)C)N([Si](C)(C)C)C(=N[Si](C)(C)C)N3CCC(O)(O)C23N1	2924.8	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #4	C[Si](C)(C)N=C1NC2C(COC(=O)NO)NC(=N[Si](C)(C)C)N3CCC(O[Si](C)(C)C)(O[Si](C)(C)C)C23N1	3280.6	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #4	C[Si](C)(C)N=C1NC2C(COC(=O)NO)NC(=N[Si](C)(C)C)N3CCC(O[Si](C)(C)C)(O[Si](C)(C)C)C23N1	2881.6	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #40	C[Si](C)(C)N=C1NC2C(COC(=O)N(O)[Si](C)(C)C)N([Si](C)(C)C)C(=N)N3CCC(O)(O)C23N1[Si](C)(C)C	3162.9	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #40	C[Si](C)(C)N=C1NC2C(COC(=O)N(O)[Si](C)(C)C)N([Si](C)(C)C)C(=N)N3CCC(O)(O)C23N1[Si](C)(C)C	3085.2	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #41	C[Si](C)(C)N=C1N2CCC(O)(O)C23C(NC(=N)N3[Si](C)(C)C)C(COC(=O)N(O)[Si](C)(C)C)N1[Si](C)(C)C	3116.0	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #41	C[Si](C)(C)N=C1N2CCC(O)(O)C23C(NC(=N)N3[Si](C)(C)C)C(COC(=O)N(O)[Si](C)(C)C)N1[Si](C)(C)C	3015.7	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #42	C[Si](C)(C)N=C1NC(COC(=O)N(O)[Si](C)(C)C)C2N([Si](C)(C)C)C(=N[Si](C)(C)C)NC23N1CCC3(O)O	3158.5	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #42	C[Si](C)(C)N=C1NC(COC(=O)N(O)[Si](C)(C)C)C2N([Si](C)(C)C)C(=N[Si](C)(C)C)NC23N1CCC3(O)O	3003.0	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #43	C[Si](C)(C)N=C1NC(COC(=O)N(O)[Si](C)(C)C)C2N([Si](C)(C)C)C(=N)N([Si](C)(C)C)C23N1CCC3(O)O	3027.6	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #43	C[Si](C)(C)N=C1NC(COC(=O)N(O)[Si](C)(C)C)C2N([Si](C)(C)C)C(=N)N([Si](C)(C)C)C23N1CCC3(O)O	3083.2	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #44	C[Si](C)(C)N=C1NC(COC(=O)N(O)[Si](C)(C)C)C2NC(=N[Si](C)(C)C)N([Si](C)(C)C)C23N1CCC3(O)O	3135.6	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #44	C[Si](C)(C)N=C1NC(COC(=O)N(O)[Si](C)(C)C)C2NC(=N[Si](C)(C)C)N([Si](C)(C)C)C23N1CCC3(O)O	3030.5	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #45	C[Si](C)(C)N=C1N([Si](C)(C)C)C2C(COC(=O)N(O)[Si](C)(C)C)NC(=N)N3CCC(O)(O)C23N1[Si](C)(C)C	3055.3	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #45	C[Si](C)(C)N=C1N([Si](C)(C)C)C2C(COC(=O)N(O)[Si](C)(C)C)NC(=N)N3CCC(O)(O)C23N1[Si](C)(C)C	2924.3	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #46	C[Si](C)(C)N=C1N2CCC(O)(O)C23C(C(COC(=O)NO)N1[Si](C)(C)C)N([Si](C)(C)C)C(=N)N3[Si](C)(C)C	3031.2	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #46	C[Si](C)(C)N=C1N2CCC(O)(O)C23C(C(COC(=O)NO)N1[Si](C)(C)C)N([Si](C)(C)C)C(=N)N3[Si](C)(C)C	3059.7	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #47	C[Si](C)(C)N=C1N2CCC(O)(O)C23C(NC(=N[Si](C)(C)C)N3[Si](C)(C)C)C(COC(=O)NO)N1[Si](C)(C)C	3141.7	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #47	C[Si](C)(C)N=C1N2CCC(O)(O)C23C(NC(=N[Si](C)(C)C)N3[Si](C)(C)C)C(COC(=O)NO)N1[Si](C)(C)C	2998.5	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #48	C[Si](C)(C)N=C1N2CCC(O)(O)C23NC(=N[Si](C)(C)C)N([Si](C)(C)C)C3C(COC(=O)NO)N1[Si](C)(C)C	3153.1	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #48	C[Si](C)(C)N=C1N2CCC(O)(O)C23NC(=N[Si](C)(C)C)N([Si](C)(C)C)C3C(COC(=O)NO)N1[Si](C)(C)C	2966.7	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #49	C[Si](C)(C)N=C1N([Si](C)(C)C)C2C(COC(=O)NO)N([Si](C)(C)C)C(=N)N3CCC(O)(O)C23N1[Si](C)(C)C	3066.3	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #49	C[Si](C)(C)N=C1N([Si](C)(C)C)C2C(COC(=O)NO)N([Si](C)(C)C)C(=N)N3CCC(O)(O)C23N1[Si](C)(C)C	3013.8	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #5	C[Si](C)(C)N=C1NC(COC(=O)NO)C2NC(=N)N([Si](C)(C)C)C23N1CCC3(O[Si](C)(C)C)O[Si](C)(C)C	3242.4	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #5	C[Si](C)(C)N=C1NC(COC(=O)NO)C2NC(=N)N([Si](C)(C)C)C23N1CCC3(O[Si](C)(C)C)O[Si](C)(C)C	2981.4	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #50	C[Si](C)(C)N=C1NC(COC(=O)NO)C2N([Si](C)(C)C)C(=N[Si](C)(C)C)N([Si](C)(C)C)C23N1CCC3(O)O	3016.4	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #50	C[Si](C)(C)N=C1NC(COC(=O)NO)C2N([Si](C)(C)C)C(=N[Si](C)(C)C)N([Si](C)(C)C)C23N1CCC3(O)O	2921.4	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #6	C[Si](C)(C)OC1(O[Si](C)(C)C)CCN2C(=N)N([Si](C)(C)C)C(COC(=O)N(O)[Si](C)(C)C)C3NC(=N)NC321	3209.5	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #6	C[Si](C)(C)OC1(O[Si](C)(C)C)CCN2C(=N)N([Si](C)(C)C)C(COC(=O)N(O)[Si](C)(C)C)C3NC(=N)NC321	2951.3	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #7	C[Si](C)(C)OC1(O[Si](C)(C)C)CCN2C(=N)N([Si](C)(C)C)C(COC(=O)NO)C3N([Si](C)(C)C)C(=N)NC321	3223.3	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #7	C[Si](C)(C)OC1(O[Si](C)(C)C)CCN2C(=N)N([Si](C)(C)C)C(COC(=O)NO)C3N([Si](C)(C)C)C(=N)NC321	3034.8	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #8	C[Si](C)(C)N=C1NC2C(COC(=O)NO)N([Si](C)(C)C)C(=N)N3CCC(O[Si](C)(C)C)(O[Si](C)(C)C)C23N1	3259.4	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #8	C[Si](C)(C)N=C1NC2C(COC(=O)NO)N([Si](C)(C)C)C(=N)N3CCC(O[Si](C)(C)C)(O[Si](C)(C)C)C23N1	2984.1	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #9	C[Si](C)(C)OC1(O[Si](C)(C)C)CCN2C(=N)N([Si](C)(C)C)C(COC(=O)NO)C3NC(=N)N([Si](C)(C)C)C321	3240.0	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TMS,isomer #9	C[Si](C)(C)OC1(O[Si](C)(C)C)CCN2C(=N)N([Si](C)(C)C)C(COC(=O)NO)C3NC(=N)N([Si](C)(C)C)C321	3080.6	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #1	C[Si](C)(C)N=C1N2CCC(O[Si](C)(C)C)(O[Si](C)(C)C)C23C(NC(=N)N3[Si](C)(C)C)C(COC(=O)NO)N1[Si](C)(C)C	3177.7	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #1	C[Si](C)(C)N=C1N2CCC(O[Si](C)(C)C)(O[Si](C)(C)C)C23C(NC(=N)N3[Si](C)(C)C)C(COC(=O)NO)N1[Si](C)(C)C	2970.5	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #10	C[Si](C)(C)N=C1NC(COC(=O)NO)C2NC(=N[Si](C)(C)C)N([Si](C)(C)C)C23N1CCC3(O[Si](C)(C)C)O[Si](C)(C)C	3165.3	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #10	C[Si](C)(C)N=C1NC(COC(=O)NO)C2NC(=N[Si](C)(C)C)N([Si](C)(C)C)C23N1CCC3(O[Si](C)(C)C)O[Si](C)(C)C	2980.0	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #11	C[Si](C)(C)OC1(O[Si](C)(C)C)CCN2C(=N)N([Si](C)(C)C)C(COC(=O)N(O)[Si](C)(C)C)C3N([Si](C)(C)C)C(=N)NC321	3190.4	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #11	C[Si](C)(C)OC1(O[Si](C)(C)C)CCN2C(=N)N([Si](C)(C)C)C(COC(=O)N(O)[Si](C)(C)C)C3N([Si](C)(C)C)C(=N)NC321	3074.2	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #12	C[Si](C)(C)N=C1NC2C(COC(=O)N(O)[Si](C)(C)C)N([Si](C)(C)C)C(=N)N3CCC(O[Si](C)(C)C)(O[Si](C)(C)C)C23N1	3181.9	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #12	C[Si](C)(C)N=C1NC2C(COC(=O)N(O)[Si](C)(C)C)N([Si](C)(C)C)C(=N)N3CCC(O[Si](C)(C)C)(O[Si](C)(C)C)C23N1	3002.4	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #13	C[Si](C)(C)OC1(O[Si](C)(C)C)CCN2C(=N)N([Si](C)(C)C)C(COC(=O)N(O)[Si](C)(C)C)C3NC(=N)N([Si](C)(C)C)C321	3189.4	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #13	C[Si](C)(C)OC1(O[Si](C)(C)C)CCN2C(=N)N([Si](C)(C)C)C(COC(=O)N(O)[Si](C)(C)C)C3NC(=N)N([Si](C)(C)C)C321	3108.5	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #14	C[Si](C)(C)N=C1NC23C(C(COC(=O)NO)N([Si](C)(C)C)C(=N)N2CCC3(O[Si](C)(C)C)O[Si](C)(C)C)N1[Si](C)(C)C	3178.3	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #14	C[Si](C)(C)N=C1NC23C(C(COC(=O)NO)N([Si](C)(C)C)C(=N)N2CCC3(O[Si](C)(C)C)O[Si](C)(C)C)N1[Si](C)(C)C	3051.7	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #15	C[Si](C)(C)OC1(O[Si](C)(C)C)CCN2C(=N)N([Si](C)(C)C)C(COC(=O)NO)C3N([Si](C)(C)C)C(=N)N([Si](C)(C)C)C321	3158.5	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #15	C[Si](C)(C)OC1(O[Si](C)(C)C)CCN2C(=N)N([Si](C)(C)C)C(COC(=O)NO)C3N([Si](C)(C)C)C(=N)N([Si](C)(C)C)C321	3165.8	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #16	C[Si](C)(C)N=C1NC2C(COC(=O)NO)N([Si](C)(C)C)C(=N)N3CCC(O[Si](C)(C)C)(O[Si](C)(C)C)C23N1[Si](C)(C)C	3192.3	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #16	C[Si](C)(C)N=C1NC2C(COC(=O)NO)N([Si](C)(C)C)C(=N)N3CCC(O[Si](C)(C)C)(O[Si](C)(C)C)C23N1[Si](C)(C)C	3087.3	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #17	C[Si](C)(C)N=C1NC23C(C(COC(=O)N(O)[Si](C)(C)C)NC(=N)N2CCC3(O[Si](C)(C)C)O[Si](C)(C)C)N1[Si](C)(C)C	3164.3	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #17	C[Si](C)(C)N=C1NC23C(C(COC(=O)N(O)[Si](C)(C)C)NC(=N)N2CCC3(O[Si](C)(C)C)O[Si](C)(C)C)N1[Si](C)(C)C	2972.7	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #18	C[Si](C)(C)OC1(O[Si](C)(C)C)CCN2C(=N)NC(COC(=O)N(O)[Si](C)(C)C)C3N([Si](C)(C)C)C(=N)N([Si](C)(C)C)C321	3145.0	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #18	C[Si](C)(C)OC1(O[Si](C)(C)C)CCN2C(=N)NC(COC(=O)N(O)[Si](C)(C)C)C3N([Si](C)(C)C)C(=N)N([Si](C)(C)C)C321	3078.2	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #19	C[Si](C)(C)N=C1NC2C(COC(=O)N(O)[Si](C)(C)C)NC(=N)N3CCC(O[Si](C)(C)C)(O[Si](C)(C)C)C23N1[Si](C)(C)C	3169.5	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #19	C[Si](C)(C)N=C1NC2C(COC(=O)N(O)[Si](C)(C)C)NC(=N)N3CCC(O[Si](C)(C)C)(O[Si](C)(C)C)C23N1[Si](C)(C)C	2973.7	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #2	C[Si](C)(C)N=C1NC2C(COC(=O)NO)N([Si](C)(C)C)C(=N[Si](C)(C)C)N3CCC(O[Si](C)(C)C)(O[Si](C)(C)C)C23N1	3182.3	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #2	C[Si](C)(C)N=C1NC2C(COC(=O)NO)N([Si](C)(C)C)C(=N[Si](C)(C)C)N3CCC(O[Si](C)(C)C)(O[Si](C)(C)C)C23N1	2880.2	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #20	C[Si](C)(C)N=C1N([Si](C)(C)C)C2C(COC(=O)NO)NC(=N)N3CCC(O[Si](C)(C)C)(O[Si](C)(C)C)C23N1[Si](C)(C)C	3136.5	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #20	C[Si](C)(C)N=C1N([Si](C)(C)C)C2C(COC(=O)NO)NC(=N)N3CCC(O[Si](C)(C)C)(O[Si](C)(C)C)C23N1[Si](C)(C)C	2883.3	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #21	C[Si](C)(C)N=C1N2CCC(O)(O[Si](C)(C)C)C23C(C(COC(=O)NO)N1[Si](C)(C)C)N([Si](C)(C)C)C(=N)N3[Si](C)(C)C	3071.3	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #21	C[Si](C)(C)N=C1N2CCC(O)(O[Si](C)(C)C)C23C(C(COC(=O)NO)N1[Si](C)(C)C)N([Si](C)(C)C)C(=N)N3[Si](C)(C)C	3075.5	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #22	C[Si](C)(C)N=C1N2CCC(O)(O[Si](C)(C)C)C23C(NC(=N[Si](C)(C)C)N3[Si](C)(C)C)C(COC(=O)NO)N1[Si](C)(C)C	3123.8	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #22	C[Si](C)(C)N=C1N2CCC(O)(O[Si](C)(C)C)C23C(NC(=N[Si](C)(C)C)N3[Si](C)(C)C)C(COC(=O)NO)N1[Si](C)(C)C	2983.0	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #23	C[Si](C)(C)N=C1N2CCC(O)(O[Si](C)(C)C)C23C(NC(=N)N3[Si](C)(C)C)C(COC(=O)N(O)[Si](C)(C)C)N1[Si](C)(C)C	3117.3	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #23	C[Si](C)(C)N=C1N2CCC(O)(O[Si](C)(C)C)C23C(NC(=N)N3[Si](C)(C)C)C(COC(=O)N(O)[Si](C)(C)C)N1[Si](C)(C)C	2999.0	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #24	C[Si](C)(C)N=C1N2CCC(O)(O[Si](C)(C)C)C23NC(=N[Si](C)(C)C)N([Si](C)(C)C)C3C(COC(=O)NO)N1[Si](C)(C)C	3133.3	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #24	C[Si](C)(C)N=C1N2CCC(O)(O[Si](C)(C)C)C23NC(=N[Si](C)(C)C)N([Si](C)(C)C)C3C(COC(=O)NO)N1[Si](C)(C)C	2963.8	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #25	C[Si](C)(C)N=C1NC2C(COC(=O)N(O)[Si](C)(C)C)N([Si](C)(C)C)C(=N[Si](C)(C)C)N3CCC(O)(O[Si](C)(C)C)C23N1	3127.7	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #25	C[Si](C)(C)N=C1NC2C(COC(=O)N(O)[Si](C)(C)C)N([Si](C)(C)C)C(=N[Si](C)(C)C)N3CCC(O)(O[Si](C)(C)C)C23N1	2910.0	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #26	C[Si](C)(C)N=C1N2CCC(O)(O[Si](C)(C)C)C23NC(=N)N([Si](C)(C)C)C3C(COC(=O)N(O)[Si](C)(C)C)N1[Si](C)(C)C	3120.8	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #26	C[Si](C)(C)N=C1N2CCC(O)(O[Si](C)(C)C)C23NC(=N)N([Si](C)(C)C)C3C(COC(=O)N(O)[Si](C)(C)C)N1[Si](C)(C)C	2988.7	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #27	C[Si](C)(C)N=C1NC(COC(=O)N(O)[Si](C)(C)C)C2N([Si](C)(C)C)C(=N[Si](C)(C)C)NC23N1CCC3(O)O[Si](C)(C)C	3122.3	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #27	C[Si](C)(C)N=C1NC(COC(=O)N(O)[Si](C)(C)C)C2N([Si](C)(C)C)C(=N[Si](C)(C)C)NC23N1CCC3(O)O[Si](C)(C)C	2997.0	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #28	C[Si](C)(C)N=C1NC(COC(=O)N(O)[Si](C)(C)C)C2N([Si](C)(C)C)C(=N)N([Si](C)(C)C)C23N1CCC3(O)O[Si](C)(C)C	3045.8	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #28	C[Si](C)(C)N=C1NC(COC(=O)N(O)[Si](C)(C)C)C2N([Si](C)(C)C)C(=N)N([Si](C)(C)C)C23N1CCC3(O)O[Si](C)(C)C	3093.0	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #29	C[Si](C)(C)N=C1NC(COC(=O)N(O)[Si](C)(C)C)C2NC(=N[Si](C)(C)C)N([Si](C)(C)C)C23N1CCC3(O)O[Si](C)(C)C	3090.5	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #29	C[Si](C)(C)N=C1NC(COC(=O)N(O)[Si](C)(C)C)C2NC(=N[Si](C)(C)C)N([Si](C)(C)C)C23N1CCC3(O)O[Si](C)(C)C	3016.4	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #3	C[Si](C)(C)N=C1N2CCC(O[Si](C)(C)C)(O[Si](C)(C)C)C23NC(=N)N([Si](C)(C)C)C3C(COC(=O)NO)N1[Si](C)(C)C	3163.4	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #3	C[Si](C)(C)N=C1N2CCC(O[Si](C)(C)C)(O[Si](C)(C)C)C23NC(=N)N([Si](C)(C)C)C3C(COC(=O)NO)N1[Si](C)(C)C	2957.7	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #30	C[Si](C)(C)N=C1NC(COC(=O)NO)C2N([Si](C)(C)C)C(=N[Si](C)(C)C)N([Si](C)(C)C)C23N1CCC3(O)O[Si](C)(C)C	3039.0	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #30	C[Si](C)(C)N=C1NC(COC(=O)NO)C2N([Si](C)(C)C)C(=N[Si](C)(C)C)N([Si](C)(C)C)C23N1CCC3(O)O[Si](C)(C)C	2899.6	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #31	C[Si](C)(C)N=C1NC23C(C(COC(=O)N(O)[Si](C)(C)C)N([Si](C)(C)C)C(=N)N2CCC3(O)O[Si](C)(C)C)N1[Si](C)(C)C	3139.7	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #31	C[Si](C)(C)N=C1NC23C(C(COC(=O)N(O)[Si](C)(C)C)N([Si](C)(C)C)C(=N)N2CCC3(O)O[Si](C)(C)C)N1[Si](C)(C)C	3073.6	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #32	C[Si](C)(C)OC1(O)CCN2C(=N)N([Si](C)(C)C)C(COC(=O)N(O)[Si](C)(C)C)C3N([Si](C)(C)C)C(=N)N([Si](C)(C)C)C321	3105.1	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #32	C[Si](C)(C)OC1(O)CCN2C(=N)N([Si](C)(C)C)C(COC(=O)N(O)[Si](C)(C)C)C3N([Si](C)(C)C)C(=N)N([Si](C)(C)C)C321	3170.8	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #33	C[Si](C)(C)N=C1NC2C(COC(=O)N(O)[Si](C)(C)C)N([Si](C)(C)C)C(=N)N3CCC(O)(O[Si](C)(C)C)C23N1[Si](C)(C)C	3143.3	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #33	C[Si](C)(C)N=C1NC2C(COC(=O)N(O)[Si](C)(C)C)N([Si](C)(C)C)C(=N)N3CCC(O)(O[Si](C)(C)C)C23N1[Si](C)(C)C	3101.5	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #34	C[Si](C)(C)N=C1N([Si](C)(C)C)C2C(COC(=O)NO)N([Si](C)(C)C)C(=N)N3CCC(O)(O[Si](C)(C)C)C23N1[Si](C)(C)C	3095.5	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #34	C[Si](C)(C)N=C1N([Si](C)(C)C)C2C(COC(=O)NO)N([Si](C)(C)C)C(=N)N3CCC(O)(O[Si](C)(C)C)C23N1[Si](C)(C)C	3032.5	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #35	C[Si](C)(C)N=C1N([Si](C)(C)C)C2C(COC(=O)N(O)[Si](C)(C)C)NC(=N)N3CCC(O)(O[Si](C)(C)C)C23N1[Si](C)(C)C	3075.9	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #35	C[Si](C)(C)N=C1N([Si](C)(C)C)C2C(COC(=O)N(O)[Si](C)(C)C)NC(=N)N3CCC(O)(O[Si](C)(C)C)C23N1[Si](C)(C)C	2924.3	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #36	C[Si](C)(C)N=C1N([Si](C)(C)C)C2C(COC(=O)N(O)[Si](C)(C)C)N([Si](C)(C)C)C(=N)N3CCC(O)(O)C23N1[Si](C)(C)C	3042.5	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #36	C[Si](C)(C)N=C1N([Si](C)(C)C)C2C(COC(=O)N(O)[Si](C)(C)C)N([Si](C)(C)C)C(=N)N3CCC(O)(O)C23N1[Si](C)(C)C	3053.6	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #37	C[Si](C)(C)N=C1N2CCC(O)(O)C23NC(=N[Si](C)(C)C)N([Si](C)(C)C)C3C(COC(=O)N(O)[Si](C)(C)C)N1[Si](C)(C)C	3096.9	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #37	C[Si](C)(C)N=C1N2CCC(O)(O)C23NC(=N[Si](C)(C)C)N([Si](C)(C)C)C3C(COC(=O)N(O)[Si](C)(C)C)N1[Si](C)(C)C	3011.2	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #38	C[Si](C)(C)N=C1N2CCC(O)(O)C23C(C(COC(=O)N(O)[Si](C)(C)C)N1[Si](C)(C)C)N([Si](C)(C)C)C(=N)N3[Si](C)(C)C	3008.5	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #38	C[Si](C)(C)N=C1N2CCC(O)(O)C23C(C(COC(=O)N(O)[Si](C)(C)C)N1[Si](C)(C)C)N([Si](C)(C)C)C(=N)N3[Si](C)(C)C	3113.7	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #39	C[Si](C)(C)N=C1N2CCC(O)(O)C23C(NC(=N[Si](C)(C)C)N3[Si](C)(C)C)C(COC(=O)N(O)[Si](C)(C)C)N1[Si](C)(C)C	3052.6	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #39	C[Si](C)(C)N=C1N2CCC(O)(O)C23C(NC(=N[Si](C)(C)C)N3[Si](C)(C)C)C(COC(=O)N(O)[Si](C)(C)C)N1[Si](C)(C)C	3037.6	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #4	C[Si](C)(C)N=C1N2CCC(O[Si](C)(C)C)(O[Si](C)(C)C)C23NC(=N)NC3C(COC(=O)N(O)[Si](C)(C)C)N1[Si](C)(C)C	3128.0	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #4	C[Si](C)(C)N=C1N2CCC(O[Si](C)(C)C)(O[Si](C)(C)C)C23NC(=N)NC3C(COC(=O)N(O)[Si](C)(C)C)N1[Si](C)(C)C	2860.6	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #40	C[Si](C)(C)N=C1NC(COC(=O)N(O)[Si](C)(C)C)C2N([Si](C)(C)C)C(=N[Si](C)(C)C)N([Si](C)(C)C)C23N1CCC3(O)O	2974.3	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #40	C[Si](C)(C)N=C1NC(COC(=O)N(O)[Si](C)(C)C)C2N([Si](C)(C)C)C(=N[Si](C)(C)C)N([Si](C)(C)C)C23N1CCC3(O)O	2968.6	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #41	C[Si](C)(C)N=C1N2CCC(O)(O)C23C(C(COC(=O)NO)N1[Si](C)(C)C)N([Si](C)(C)C)C(=N[Si](C)(C)C)N3[Si](C)(C)C	3010.9	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #41	C[Si](C)(C)N=C1N2CCC(O)(O)C23C(C(COC(=O)NO)N1[Si](C)(C)C)N([Si](C)(C)C)C(=N[Si](C)(C)C)N3[Si](C)(C)C	2952.8	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #5	C[Si](C)(C)N=C1NC(COC(=O)N(O)[Si](C)(C)C)C2N([Si](C)(C)C)C(=N)NC23N1CCC3(O[Si](C)(C)C)O[Si](C)(C)C	3157.3	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #5	C[Si](C)(C)N=C1NC(COC(=O)N(O)[Si](C)(C)C)C2N([Si](C)(C)C)C(=N)NC23N1CCC3(O[Si](C)(C)C)O[Si](C)(C)C	2992.0	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #6	C[Si](C)(C)N=C1NC2C(COC(=O)N(O)[Si](C)(C)C)NC(=N[Si](C)(C)C)N3CCC(O[Si](C)(C)C)(O[Si](C)(C)C)C23N1	3195.2	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #6	C[Si](C)(C)N=C1NC2C(COC(=O)N(O)[Si](C)(C)C)NC(=N[Si](C)(C)C)N3CCC(O[Si](C)(C)C)(O[Si](C)(C)C)C23N1	2911.8	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #7	C[Si](C)(C)N=C1NC(COC(=O)N(O)[Si](C)(C)C)C2NC(=N)N([Si](C)(C)C)C23N1CCC3(O[Si](C)(C)C)O[Si](C)(C)C	3170.0	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #7	C[Si](C)(C)N=C1NC(COC(=O)N(O)[Si](C)(C)C)C2NC(=N)N([Si](C)(C)C)C23N1CCC3(O[Si](C)(C)C)O[Si](C)(C)C	2998.6	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #8	C[Si](C)(C)N=C1NC(COC(=O)NO)C2N([Si](C)(C)C)C(=N[Si](C)(C)C)NC23N1CCC3(O[Si](C)(C)C)O[Si](C)(C)C	3176.7	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #8	C[Si](C)(C)N=C1NC(COC(=O)NO)C2N([Si](C)(C)C)C(=N[Si](C)(C)C)NC23N1CCC3(O[Si](C)(C)C)O[Si](C)(C)C	2957.0	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #9	C[Si](C)(C)N=C1NC(COC(=O)NO)C2N([Si](C)(C)C)C(=N)N([Si](C)(C)C)C23N1CCC3(O[Si](C)(C)C)O[Si](C)(C)C	3108.4	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TMS,isomer #9	C[Si](C)(C)N=C1NC(COC(=O)NO)C2N([Si](C)(C)C)C(=N)N([Si](C)(C)C)C23N1CCC3(O[Si](C)(C)C)O[Si](C)(C)C	3065.2	Standard non polar	33892256
N'-Hydroxysaxitoxin,6TMS,isomer #1	C[Si](C)(C)N=C1N2CCC(O[Si](C)(C)C)(O[Si](C)(C)C)C23C(C(COC(=O)NO)N1[Si](C)(C)C)N([Si](C)(C)C)C(=N)N3[Si](C)(C)C	3125.1	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,6TMS,isomer #1	C[Si](C)(C)N=C1N2CCC(O[Si](C)(C)C)(O[Si](C)(C)C)C23C(C(COC(=O)NO)N1[Si](C)(C)C)N([Si](C)(C)C)C(=N)N3[Si](C)(C)C	3075.4	Standard non polar	33892256
N'-Hydroxysaxitoxin,6TMS,isomer #10	C[Si](C)(C)N=C1NC(COC(=O)NO)C2N([Si](C)(C)C)C(=N[Si](C)(C)C)N([Si](C)(C)C)C23N1CCC3(O[Si](C)(C)C)O[Si](C)(C)C	3088.6	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,6TMS,isomer #10	C[Si](C)(C)N=C1NC(COC(=O)NO)C2N([Si](C)(C)C)C(=N[Si](C)(C)C)N([Si](C)(C)C)C23N1CCC3(O[Si](C)(C)C)O[Si](C)(C)C	2902.6	Standard non polar	33892256
N'-Hydroxysaxitoxin,6TMS,isomer #11	C[Si](C)(C)N=C1NC23C(C(COC(=O)N(O)[Si](C)(C)C)N([Si](C)(C)C)C(=N)N2CCC3(O[Si](C)(C)C)O[Si](C)(C)C)N1[Si](C)(C)C	3164.3	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,6TMS,isomer #11	C[Si](C)(C)N=C1NC23C(C(COC(=O)N(O)[Si](C)(C)C)N([Si](C)(C)C)C(=N)N2CCC3(O[Si](C)(C)C)O[Si](C)(C)C)N1[Si](C)(C)C	3074.0	Standard non polar	33892256
N'-Hydroxysaxitoxin,6TMS,isomer #12	C[Si](C)(C)OC1(O[Si](C)(C)C)CCN2C(=N)N([Si](C)(C)C)C(COC(=O)N(O)[Si](C)(C)C)C3N([Si](C)(C)C)C(=N)N([Si](C)(C)C)C321	3143.6	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,6TMS,isomer #12	C[Si](C)(C)OC1(O[Si](C)(C)C)CCN2C(=N)N([Si](C)(C)C)C(COC(=O)N(O)[Si](C)(C)C)C3N([Si](C)(C)C)C(=N)N([Si](C)(C)C)C321	3183.6	Standard non polar	33892256
N'-Hydroxysaxitoxin,6TMS,isomer #13	C[Si](C)(C)N=C1NC2C(COC(=O)N(O)[Si](C)(C)C)N([Si](C)(C)C)C(=N)N3CCC(O[Si](C)(C)C)(O[Si](C)(C)C)C23N1[Si](C)(C)C	3163.8	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,6TMS,isomer #13	C[Si](C)(C)N=C1NC2C(COC(=O)N(O)[Si](C)(C)C)N([Si](C)(C)C)C(=N)N3CCC(O[Si](C)(C)C)(O[Si](C)(C)C)C23N1[Si](C)(C)C	3095.2	Standard non polar	33892256
N'-Hydroxysaxitoxin,6TMS,isomer #14	C[Si](C)(C)N=C1N([Si](C)(C)C)C2C(COC(=O)NO)N([Si](C)(C)C)C(=N)N3CCC(O[Si](C)(C)C)(O[Si](C)(C)C)C23N1[Si](C)(C)C	3149.5	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,6TMS,isomer #14	C[Si](C)(C)N=C1N([Si](C)(C)C)C2C(COC(=O)NO)N([Si](C)(C)C)C(=N)N3CCC(O[Si](C)(C)C)(O[Si](C)(C)C)C23N1[Si](C)(C)C	3045.4	Standard non polar	33892256
N'-Hydroxysaxitoxin,6TMS,isomer #15	C[Si](C)(C)N=C1N([Si](C)(C)C)C2C(COC(=O)N(O)[Si](C)(C)C)NC(=N)N3CCC(O[Si](C)(C)C)(O[Si](C)(C)C)C23N1[Si](C)(C)C	3106.9	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,6TMS,isomer #15	C[Si](C)(C)N=C1N([Si](C)(C)C)C2C(COC(=O)N(O)[Si](C)(C)C)NC(=N)N3CCC(O[Si](C)(C)C)(O[Si](C)(C)C)C23N1[Si](C)(C)C	2938.5	Standard non polar	33892256
N'-Hydroxysaxitoxin,6TMS,isomer #16	C[Si](C)(C)N=C1N2CCC(O)(O[Si](C)(C)C)C23C(C(COC(=O)N(O)[Si](C)(C)C)N1[Si](C)(C)C)N([Si](C)(C)C)C(=N)N3[Si](C)(C)C	3052.0	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,6TMS,isomer #16	C[Si](C)(C)N=C1N2CCC(O)(O[Si](C)(C)C)C23C(C(COC(=O)N(O)[Si](C)(C)C)N1[Si](C)(C)C)N([Si](C)(C)C)C(=N)N3[Si](C)(C)C	3100.9	Standard non polar	33892256
N'-Hydroxysaxitoxin,6TMS,isomer #17	C[Si](C)(C)N=C1N2CCC(O)(O[Si](C)(C)C)C23C(C(COC(=O)NO)N1[Si](C)(C)C)N([Si](C)(C)C)C(=N[Si](C)(C)C)N3[Si](C)(C)C	3062.0	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,6TMS,isomer #17	C[Si](C)(C)N=C1N2CCC(O)(O[Si](C)(C)C)C23C(C(COC(=O)NO)N1[Si](C)(C)C)N([Si](C)(C)C)C(=N[Si](C)(C)C)N3[Si](C)(C)C	2924.7	Standard non polar	33892256
N'-Hydroxysaxitoxin,6TMS,isomer #18	C[Si](C)(C)N=C1N2CCC(O)(O[Si](C)(C)C)C23C(NC(=N[Si](C)(C)C)N3[Si](C)(C)C)C(COC(=O)N(O)[Si](C)(C)C)N1[Si](C)(C)C	3082.0	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,6TMS,isomer #18	C[Si](C)(C)N=C1N2CCC(O)(O[Si](C)(C)C)C23C(NC(=N[Si](C)(C)C)N3[Si](C)(C)C)C(COC(=O)N(O)[Si](C)(C)C)N1[Si](C)(C)C	3012.0	Standard non polar	33892256
N'-Hydroxysaxitoxin,6TMS,isomer #19	C[Si](C)(C)N=C1N2CCC(O)(O[Si](C)(C)C)C23NC(=N[Si](C)(C)C)N([Si](C)(C)C)C3C(COC(=O)N(O)[Si](C)(C)C)N1[Si](C)(C)C	3104.6	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,6TMS,isomer #19	C[Si](C)(C)N=C1N2CCC(O)(O[Si](C)(C)C)C23NC(=N[Si](C)(C)C)N([Si](C)(C)C)C3C(COC(=O)N(O)[Si](C)(C)C)N1[Si](C)(C)C	3000.2	Standard non polar	33892256
N'-Hydroxysaxitoxin,6TMS,isomer #2	C[Si](C)(C)N=C1N2CCC(O[Si](C)(C)C)(O[Si](C)(C)C)C23C(NC(=N[Si](C)(C)C)N3[Si](C)(C)C)C(COC(=O)NO)N1[Si](C)(C)C	3139.4	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,6TMS,isomer #2	C[Si](C)(C)N=C1N2CCC(O[Si](C)(C)C)(O[Si](C)(C)C)C23C(NC(=N[Si](C)(C)C)N3[Si](C)(C)C)C(COC(=O)NO)N1[Si](C)(C)C	2974.8	Standard non polar	33892256
N'-Hydroxysaxitoxin,6TMS,isomer #20	C[Si](C)(C)N=C1NC(COC(=O)N(O)[Si](C)(C)C)C2N([Si](C)(C)C)C(=N[Si](C)(C)C)N([Si](C)(C)C)C23N1CCC3(O)O[Si](C)(C)C	3023.2	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,6TMS,isomer #20	C[Si](C)(C)N=C1NC(COC(=O)N(O)[Si](C)(C)C)C2N([Si](C)(C)C)C(=N[Si](C)(C)C)N([Si](C)(C)C)C23N1CCC3(O)O[Si](C)(C)C	2945.5	Standard non polar	33892256
N'-Hydroxysaxitoxin,6TMS,isomer #21	C[Si](C)(C)N=C1N([Si](C)(C)C)C2C(COC(=O)N(O)[Si](C)(C)C)N([Si](C)(C)C)C(=N)N3CCC(O)(O[Si](C)(C)C)C23N1[Si](C)(C)C	3077.9	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,6TMS,isomer #21	C[Si](C)(C)N=C1N([Si](C)(C)C)C2C(COC(=O)N(O)[Si](C)(C)C)N([Si](C)(C)C)C(=N)N3CCC(O)(O[Si](C)(C)C)C23N1[Si](C)(C)C	3064.8	Standard non polar	33892256
N'-Hydroxysaxitoxin,6TMS,isomer #22	C[Si](C)(C)N=C1N2CCC(O)(O)C23C(C(COC(=O)N(O)[Si](C)(C)C)N1[Si](C)(C)C)N([Si](C)(C)C)C(=N[Si](C)(C)C)N3[Si](C)(C)C	2997.3	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,6TMS,isomer #22	C[Si](C)(C)N=C1N2CCC(O)(O)C23C(C(COC(=O)N(O)[Si](C)(C)C)N1[Si](C)(C)C)N([Si](C)(C)C)C(=N[Si](C)(C)C)N3[Si](C)(C)C	2994.0	Standard non polar	33892256
N'-Hydroxysaxitoxin,6TMS,isomer #3	C[Si](C)(C)N=C1N2CCC(O[Si](C)(C)C)(O[Si](C)(C)C)C23C(NC(=N)N3[Si](C)(C)C)C(COC(=O)N(O)[Si](C)(C)C)N1[Si](C)(C)C	3142.6	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,6TMS,isomer #3	C[Si](C)(C)N=C1N2CCC(O[Si](C)(C)C)(O[Si](C)(C)C)C23C(NC(=N)N3[Si](C)(C)C)C(COC(=O)N(O)[Si](C)(C)C)N1[Si](C)(C)C	2998.2	Standard non polar	33892256
N'-Hydroxysaxitoxin,6TMS,isomer #4	C[Si](C)(C)N=C1N2CCC(O[Si](C)(C)C)(O[Si](C)(C)C)C23NC(=N[Si](C)(C)C)N([Si](C)(C)C)C3C(COC(=O)NO)N1[Si](C)(C)C	3151.9	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,6TMS,isomer #4	C[Si](C)(C)N=C1N2CCC(O[Si](C)(C)C)(O[Si](C)(C)C)C23NC(=N[Si](C)(C)C)N([Si](C)(C)C)C3C(COC(=O)NO)N1[Si](C)(C)C	2968.4	Standard non polar	33892256
N'-Hydroxysaxitoxin,6TMS,isomer #5	C[Si](C)(C)N=C1NC2C(COC(=O)N(O)[Si](C)(C)C)N([Si](C)(C)C)C(=N[Si](C)(C)C)N3CCC(O[Si](C)(C)C)(O[Si](C)(C)C)C23N1	3114.2	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,6TMS,isomer #5	C[Si](C)(C)N=C1NC2C(COC(=O)N(O)[Si](C)(C)C)N([Si](C)(C)C)C(=N[Si](C)(C)C)N3CCC(O[Si](C)(C)C)(O[Si](C)(C)C)C23N1	2920.4	Standard non polar	33892256
N'-Hydroxysaxitoxin,6TMS,isomer #6	C[Si](C)(C)N=C1N2CCC(O[Si](C)(C)C)(O[Si](C)(C)C)C23NC(=N)N([Si](C)(C)C)C3C(COC(=O)N(O)[Si](C)(C)C)N1[Si](C)(C)C	3149.7	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,6TMS,isomer #6	C[Si](C)(C)N=C1N2CCC(O[Si](C)(C)C)(O[Si](C)(C)C)C23NC(=N)N([Si](C)(C)C)C3C(COC(=O)N(O)[Si](C)(C)C)N1[Si](C)(C)C	2998.6	Standard non polar	33892256
N'-Hydroxysaxitoxin,6TMS,isomer #7	C[Si](C)(C)N=C1NC(COC(=O)N(O)[Si](C)(C)C)C2N([Si](C)(C)C)C(=N[Si](C)(C)C)NC23N1CCC3(O[Si](C)(C)C)O[Si](C)(C)C	3168.3	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,6TMS,isomer #7	C[Si](C)(C)N=C1NC(COC(=O)N(O)[Si](C)(C)C)C2N([Si](C)(C)C)C(=N[Si](C)(C)C)NC23N1CCC3(O[Si](C)(C)C)O[Si](C)(C)C	2997.6	Standard non polar	33892256
N'-Hydroxysaxitoxin,6TMS,isomer #8	C[Si](C)(C)N=C1NC(COC(=O)N(O)[Si](C)(C)C)C2N([Si](C)(C)C)C(=N)N([Si](C)(C)C)C23N1CCC3(O[Si](C)(C)C)O[Si](C)(C)C	3087.5	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,6TMS,isomer #8	C[Si](C)(C)N=C1NC(COC(=O)N(O)[Si](C)(C)C)C2N([Si](C)(C)C)C(=N)N([Si](C)(C)C)C23N1CCC3(O[Si](C)(C)C)O[Si](C)(C)C	3091.2	Standard non polar	33892256
N'-Hydroxysaxitoxin,6TMS,isomer #9	C[Si](C)(C)N=C1NC(COC(=O)N(O)[Si](C)(C)C)C2NC(=N[Si](C)(C)C)N([Si](C)(C)C)C23N1CCC3(O[Si](C)(C)C)O[Si](C)(C)C	3149.2	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,6TMS,isomer #9	C[Si](C)(C)N=C1NC(COC(=O)N(O)[Si](C)(C)C)C2NC(=N[Si](C)(C)C)N([Si](C)(C)C)C23N1CCC3(O[Si](C)(C)C)O[Si](C)(C)C	3009.5	Standard non polar	33892256
N'-Hydroxysaxitoxin,7TMS,isomer #1	C[Si](C)(C)N=C1N2CCC(O[Si](C)(C)C)(O[Si](C)(C)C)C23C(C(COC(=O)N(O)[Si](C)(C)C)N1[Si](C)(C)C)N([Si](C)(C)C)C(=N)N3[Si](C)(C)C	3116.5	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,7TMS,isomer #1	C[Si](C)(C)N=C1N2CCC(O[Si](C)(C)C)(O[Si](C)(C)C)C23C(C(COC(=O)N(O)[Si](C)(C)C)N1[Si](C)(C)C)N([Si](C)(C)C)C(=N)N3[Si](C)(C)C	3101.0	Standard non polar	33892256
N'-Hydroxysaxitoxin,7TMS,isomer #2	C[Si](C)(C)N=C1N2CCC(O[Si](C)(C)C)(O[Si](C)(C)C)C23C(C(COC(=O)NO)N1[Si](C)(C)C)N([Si](C)(C)C)C(=N[Si](C)(C)C)N3[Si](C)(C)C	3136.3	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,7TMS,isomer #2	C[Si](C)(C)N=C1N2CCC(O[Si](C)(C)C)(O[Si](C)(C)C)C23C(C(COC(=O)NO)N1[Si](C)(C)C)N([Si](C)(C)C)C(=N[Si](C)(C)C)N3[Si](C)(C)C	2937.2	Standard non polar	33892256
N'-Hydroxysaxitoxin,7TMS,isomer #3	C[Si](C)(C)N=C1N2CCC(O[Si](C)(C)C)(O[Si](C)(C)C)C23C(NC(=N[Si](C)(C)C)N3[Si](C)(C)C)C(COC(=O)N(O)[Si](C)(C)C)N1[Si](C)(C)C	3143.0	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,7TMS,isomer #3	C[Si](C)(C)N=C1N2CCC(O[Si](C)(C)C)(O[Si](C)(C)C)C23C(NC(=N[Si](C)(C)C)N3[Si](C)(C)C)C(COC(=O)N(O)[Si](C)(C)C)N1[Si](C)(C)C	3019.7	Standard non polar	33892256
N'-Hydroxysaxitoxin,7TMS,isomer #4	C[Si](C)(C)N=C1N2CCC(O[Si](C)(C)C)(O[Si](C)(C)C)C23NC(=N[Si](C)(C)C)N([Si](C)(C)C)C3C(COC(=O)N(O)[Si](C)(C)C)N1[Si](C)(C)C	3157.9	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,7TMS,isomer #4	C[Si](C)(C)N=C1N2CCC(O[Si](C)(C)C)(O[Si](C)(C)C)C23NC(=N[Si](C)(C)C)N([Si](C)(C)C)C3C(COC(=O)N(O)[Si](C)(C)C)N1[Si](C)(C)C	3019.3	Standard non polar	33892256
N'-Hydroxysaxitoxin,7TMS,isomer #5	C[Si](C)(C)N=C1NC(COC(=O)N(O)[Si](C)(C)C)C2N([Si](C)(C)C)C(=N[Si](C)(C)C)N([Si](C)(C)C)C23N1CCC3(O[Si](C)(C)C)O[Si](C)(C)C	3077.3	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,7TMS,isomer #5	C[Si](C)(C)N=C1NC(COC(=O)N(O)[Si](C)(C)C)C2N([Si](C)(C)C)C(=N[Si](C)(C)C)N([Si](C)(C)C)C23N1CCC3(O[Si](C)(C)C)O[Si](C)(C)C	2961.5	Standard non polar	33892256
N'-Hydroxysaxitoxin,7TMS,isomer #6	C[Si](C)(C)N=C1N([Si](C)(C)C)C2C(COC(=O)N(O)[Si](C)(C)C)N([Si](C)(C)C)C(=N)N3CCC(O[Si](C)(C)C)(O[Si](C)(C)C)C23N1[Si](C)(C)C	3138.4	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,7TMS,isomer #6	C[Si](C)(C)N=C1N([Si](C)(C)C)C2C(COC(=O)N(O)[Si](C)(C)C)N([Si](C)(C)C)C(=N)N3CCC(O[Si](C)(C)C)(O[Si](C)(C)C)C23N1[Si](C)(C)C	3085.8	Standard non polar	33892256
N'-Hydroxysaxitoxin,7TMS,isomer #7	C[Si](C)(C)N=C1N2CCC(O)(O[Si](C)(C)C)C23C(C(COC(=O)N(O)[Si](C)(C)C)N1[Si](C)(C)C)N([Si](C)(C)C)C(=N[Si](C)(C)C)N3[Si](C)(C)C	3051.7	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,7TMS,isomer #7	C[Si](C)(C)N=C1N2CCC(O)(O[Si](C)(C)C)C23C(C(COC(=O)N(O)[Si](C)(C)C)N1[Si](C)(C)C)N([Si](C)(C)C)C(=N[Si](C)(C)C)N3[Si](C)(C)C	2981.3	Standard non polar	33892256
N'-Hydroxysaxitoxin,8TMS,isomer #1	C[Si](C)(C)N=C1N2CCC(O[Si](C)(C)C)(O[Si](C)(C)C)C23C(C(COC(=O)N(O)[Si](C)(C)C)N1[Si](C)(C)C)N([Si](C)(C)C)C(=N[Si](C)(C)C)N3[Si](C)(C)C	3125.8	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,8TMS,isomer #1	C[Si](C)(C)N=C1N2CCC(O[Si](C)(C)C)(O[Si](C)(C)C)C23C(C(COC(=O)N(O)[Si](C)(C)C)N1[Si](C)(C)C)N([Si](C)(C)C)C(=N[Si](C)(C)C)N3[Si](C)(C)C	3011.4	Standard non polar	33892256
N'-Hydroxysaxitoxin,1TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC1(O)CCN2C(=N)NC(COC(=O)NO)C3NC(=N)NC321	3684.8	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,1TBDMS,isomer #2	CC(C)(C)[Si](C)(C)N(O)C(=O)OCC1NC(=N)N2CCC(O)(O)C23NC(=N)NC13	3678.4	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,1TBDMS,isomer #3	CC(C)(C)[Si](C)(C)N1C(=N)N2CCC(O)(O)C23NC(=N)NC3C1COC(=O)NO	3677.2	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,1TBDMS,isomer #4	CC(C)(C)[Si](C)(C)N=C1NC(COC(=O)NO)C2NC(=N)NC23N1CCC3(O)O	3689.3	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,1TBDMS,isomer #5	CC(C)(C)[Si](C)(C)N1C(=N)NC2C(COC(=O)NO)NC(=N)N3CCC(O)(O)C231	3644.6	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,1TBDMS,isomer #6	CC(C)(C)[Si](C)(C)N=C1NC2C(COC(=O)NO)NC(=N)N3CCC(O)(O)C23N1	3708.7	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,1TBDMS,isomer #7	CC(C)(C)[Si](C)(C)N1C(=N)NC23C1C(COC(=O)NO)NC(=N)N2CCC3(O)O	3660.3	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,2TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC1(O[Si](C)(C)C(C)(C)C)CCN2C(=N)NC(COC(=O)NO)C3NC(=N)NC321	3828.4	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,2TBDMS,isomer #10	CC(C)(C)[Si](C)(C)N(O)C(=O)OCC1NC(=N)N2CCC(O)(O)C23C1NC(=N)N3[Si](C)(C)C(C)(C)C	3772.1	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,2TBDMS,isomer #11	CC(C)(C)[Si](C)(C)N=C1NC2C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)NC(=N)N3CCC(O)(O)C23N1	3877.5	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,2TBDMS,isomer #12	CC(C)(C)[Si](C)(C)N(O)C(=O)OCC1NC(=N)N2CCC(O)(O)C23NC(=N)N([Si](C)(C)C(C)(C)C)C13	3815.3	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,2TBDMS,isomer #13	CC(C)(C)[Si](C)(C)N=C1N2CCC(O)(O)C23NC(=N)NC3C(COC(=O)NO)N1[Si](C)(C)C(C)(C)C	3790.8	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,2TBDMS,isomer #14	CC(C)(C)[Si](C)(C)N1C(=N)N2CCC(O)(O)C23C(NC(=N)N3[Si](C)(C)C(C)(C)C)C1COC(=O)NO	3779.1	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,2TBDMS,isomer #15	CC(C)(C)[Si](C)(C)N=C1NC2C(COC(=O)NO)N([Si](C)(C)C(C)(C)C)C(=N)N3CCC(O)(O)C23N1	3831.5	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,2TBDMS,isomer #16	CC(C)(C)[Si](C)(C)N1C(=N)N2CCC(O)(O)C23NC(=N)N([Si](C)(C)C(C)(C)C)C3C1COC(=O)NO	3803.0	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,2TBDMS,isomer #17	CC(C)(C)[Si](C)(C)N=C1NC(COC(=O)NO)C2N([Si](C)(C)C(C)(C)C)C(=N)NC23N1CCC3(O)O	3812.8	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,2TBDMS,isomer #18	CC(C)(C)[Si](C)(C)N=C1NC2C(COC(=O)NO)NC(=N[Si](C)(C)C(C)(C)C)N3CCC(O)(O)C23N1	3801.8	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,2TBDMS,isomer #19	CC(C)(C)[Si](C)(C)N=C1NC(COC(=O)NO)C2NC(=N)N([Si](C)(C)C(C)(C)C)C23N1CCC3(O)O	3769.5	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,2TBDMS,isomer #2	CC(C)(C)[Si](C)(C)N=C1NC(COC(=O)NO)C2NC(=N)NC23N1CCC3(O)O[Si](C)(C)C(C)(C)C	3812.7	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,2TBDMS,isomer #20	CC(C)(C)[Si](C)(C)N=C1NC2C(COC(=O)NO)NC(=N)N3CCC(O)(O)C23N1[Si](C)(C)C(C)(C)C	3751.0	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,2TBDMS,isomer #21	CC(C)(C)[Si](C)(C)N1C(=N)N([Si](C)(C)C(C)(C)C)C23C1C(COC(=O)NO)NC(=N)N2CCC3(O)O	3658.9	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,2TBDMS,isomer #22	CC(C)(C)[Si](C)(C)N=C1NC23C(C(COC(=O)NO)NC(=N)N2CCC3(O)O)N1[Si](C)(C)C(C)(C)C	3786.0	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,2TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC1(O)CCN2C(=N)N([Si](C)(C)C(C)(C)C)C(COC(=O)NO)C3NC(=N)NC321	3820.8	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,2TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC1(O)CCN2C(=N)NC(COC(=O)N(O)[Si](C)(C)C(C)(C)C)C3NC(=N)NC321	3876.0	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,2TBDMS,isomer #5	CC(C)(C)[Si](C)(C)OC1(O)CCN2C(=N)NC(COC(=O)NO)C3N([Si](C)(C)C(C)(C)C)C(=N)NC321	3852.5	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,2TBDMS,isomer #6	CC(C)(C)[Si](C)(C)N=C1NC2C(COC(=O)NO)NC(=N)N3CCC(O)(O[Si](C)(C)C(C)(C)C)C23N1	3847.3	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,2TBDMS,isomer #7	CC(C)(C)[Si](C)(C)OC1(O)CCN2C(=N)NC(COC(=O)NO)C3NC(=N)N([Si](C)(C)C(C)(C)C)C321	3840.8	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,2TBDMS,isomer #8	CC(C)(C)[Si](C)(C)N(O)C(=O)OCC1C2NC(=N)NC23N(CCC3(O)O)C(=N)N1[Si](C)(C)C(C)(C)C	3822.8	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,2TBDMS,isomer #9	CC(C)(C)[Si](C)(C)N=C1NC(COC(=O)N(O)[Si](C)(C)C(C)(C)C)C2NC(=N)NC23N1CCC3(O)O	3829.5	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #1	CC(C)(C)[Si](C)(C)N=C1NC(COC(=O)NO)C2NC(=N)NC23N1CCC3(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	3911.0	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #1	CC(C)(C)[Si](C)(C)N=C1NC(COC(=O)NO)C2NC(=N)NC23N1CCC3(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	3540.2	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #10	CC(C)(C)[Si](C)(C)N=C1NC2C(COC(=O)NO)NC(=N[Si](C)(C)C(C)(C)C)N3CCC(O)(O[Si](C)(C)C(C)(C)C)C23N1	3921.8	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #10	CC(C)(C)[Si](C)(C)N=C1NC2C(COC(=O)NO)NC(=N[Si](C)(C)C(C)(C)C)N3CCC(O)(O[Si](C)(C)C(C)(C)C)C23N1	3565.2	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #11	CC(C)(C)[Si](C)(C)N=C1NC(COC(=O)NO)C2NC(=N)N([Si](C)(C)C(C)(C)C)C23N1CCC3(O)O[Si](C)(C)C(C)(C)C	3895.6	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #11	CC(C)(C)[Si](C)(C)N=C1NC(COC(=O)NO)C2NC(=N)N([Si](C)(C)C(C)(C)C)C23N1CCC3(O)O[Si](C)(C)C(C)(C)C	3638.7	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #12	CC(C)(C)[Si](C)(C)OC1(O)CCN2C(=N)N([Si](C)(C)C(C)(C)C)C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)C3NC(=N)NC321	3971.3	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #12	CC(C)(C)[Si](C)(C)OC1(O)CCN2C(=N)N([Si](C)(C)C(C)(C)C)C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)C3NC(=N)NC321	3634.0	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #13	CC(C)(C)[Si](C)(C)OC1(O)CCN2C(=N)N([Si](C)(C)C(C)(C)C)C(COC(=O)NO)C3N([Si](C)(C)C(C)(C)C)C(=N)NC321	3938.6	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #13	CC(C)(C)[Si](C)(C)OC1(O)CCN2C(=N)N([Si](C)(C)C(C)(C)C)C(COC(=O)NO)C3N([Si](C)(C)C(C)(C)C)C(=N)NC321	3696.7	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #14	CC(C)(C)[Si](C)(C)N=C1NC2C(COC(=O)NO)N([Si](C)(C)C(C)(C)C)C(=N)N3CCC(O)(O[Si](C)(C)C(C)(C)C)C23N1	3954.7	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #14	CC(C)(C)[Si](C)(C)N=C1NC2C(COC(=O)NO)N([Si](C)(C)C(C)(C)C)C(=N)N3CCC(O)(O[Si](C)(C)C(C)(C)C)C23N1	3685.4	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #15	CC(C)(C)[Si](C)(C)OC1(O)CCN2C(=N)N([Si](C)(C)C(C)(C)C)C(COC(=O)NO)C3NC(=N)N([Si](C)(C)C(C)(C)C)C321	3933.2	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #15	CC(C)(C)[Si](C)(C)OC1(O)CCN2C(=N)N([Si](C)(C)C(C)(C)C)C(COC(=O)NO)C3NC(=N)N([Si](C)(C)C(C)(C)C)C321	3693.6	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #16	CC(C)(C)[Si](C)(C)OC1(O)CCN2C(=N)NC(COC(=O)N(O)[Si](C)(C)C(C)(C)C)C3N([Si](C)(C)C(C)(C)C)C(=N)NC321	3965.8	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #16	CC(C)(C)[Si](C)(C)OC1(O)CCN2C(=N)NC(COC(=O)N(O)[Si](C)(C)C(C)(C)C)C3N([Si](C)(C)C(C)(C)C)C(=N)NC321	3650.6	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #17	CC(C)(C)[Si](C)(C)N=C1NC2C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)NC(=N)N3CCC(O)(O[Si](C)(C)C(C)(C)C)C23N1	3998.8	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #17	CC(C)(C)[Si](C)(C)N=C1NC2C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)NC(=N)N3CCC(O)(O[Si](C)(C)C(C)(C)C)C23N1	3630.3	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #18	CC(C)(C)[Si](C)(C)OC1(O)CCN2C(=N)NC(COC(=O)N(O)[Si](C)(C)C(C)(C)C)C3NC(=N)N([Si](C)(C)C(C)(C)C)C321	3943.5	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #18	CC(C)(C)[Si](C)(C)OC1(O)CCN2C(=N)NC(COC(=O)N(O)[Si](C)(C)C(C)(C)C)C3NC(=N)N([Si](C)(C)C(C)(C)C)C321	3617.6	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #19	CC(C)(C)[Si](C)(C)N=C1NC23C(C(COC(=O)NO)NC(=N)N2CCC3(O)O[Si](C)(C)C(C)(C)C)N1[Si](C)(C)C(C)(C)C	3927.5	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #19	CC(C)(C)[Si](C)(C)N=C1NC23C(C(COC(=O)NO)NC(=N)N2CCC3(O)O[Si](C)(C)C(C)(C)C)N1[Si](C)(C)C(C)(C)C	3620.9	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC1(O[Si](C)(C)C(C)(C)C)CCN2C(=N)N([Si](C)(C)C(C)(C)C)C(COC(=O)NO)C3NC(=N)NC321	3949.2	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC1(O[Si](C)(C)C(C)(C)C)CCN2C(=N)N([Si](C)(C)C(C)(C)C)C(COC(=O)NO)C3NC(=N)NC321	3617.2	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #20	CC(C)(C)[Si](C)(C)OC1(O)CCN2C(=N)NC(COC(=O)NO)C3N([Si](C)(C)C(C)(C)C)C(=N)N([Si](C)(C)C(C)(C)C)C321	3835.9	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #20	CC(C)(C)[Si](C)(C)OC1(O)CCN2C(=N)NC(COC(=O)NO)C3N([Si](C)(C)C(C)(C)C)C(=N)N([Si](C)(C)C(C)(C)C)C321	3663.0	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #21	CC(C)(C)[Si](C)(C)N=C1NC2C(COC(=O)NO)NC(=N)N3CCC(O)(O[Si](C)(C)C(C)(C)C)C23N1[Si](C)(C)C(C)(C)C	3896.6	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #21	CC(C)(C)[Si](C)(C)N=C1NC2C(COC(=O)NO)NC(=N)N3CCC(O)(O[Si](C)(C)C(C)(C)C)C23N1[Si](C)(C)C(C)(C)C	3589.6	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #22	CC(C)(C)[Si](C)(C)N(O)C(=O)OCC1C2N([Si](C)(C)C(C)(C)C)C(=N)NC23N(CCC3(O)O)C(=N)N1[Si](C)(C)C(C)(C)C	3939.3	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #22	CC(C)(C)[Si](C)(C)N(O)C(=O)OCC1C2N([Si](C)(C)C(C)(C)C)C(=N)NC23N(CCC3(O)O)C(=N)N1[Si](C)(C)C(C)(C)C	3723.0	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #23	CC(C)(C)[Si](C)(C)N=C1NC2C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)C(=N)N3CCC(O)(O)C23N1	3959.7	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #23	CC(C)(C)[Si](C)(C)N=C1NC2C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)C(=N)N3CCC(O)(O)C23N1	3706.3	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #24	CC(C)(C)[Si](C)(C)N(O)C(=O)OCC1C2NC(=N)N([Si](C)(C)C(C)(C)C)C23N(CCC3(O)O)C(=N)N1[Si](C)(C)C(C)(C)C	3896.8	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #24	CC(C)(C)[Si](C)(C)N(O)C(=O)OCC1C2NC(=N)N([Si](C)(C)C(C)(C)C)C23N(CCC3(O)O)C(=N)N1[Si](C)(C)C(C)(C)C	3691.8	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #25	CC(C)(C)[Si](C)(C)N=C1N2CCC(O)(O)C23NC(=N)NC3C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)N1[Si](C)(C)C(C)(C)C	3904.2	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #25	CC(C)(C)[Si](C)(C)N=C1N2CCC(O)(O)C23NC(=N)NC3C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)N1[Si](C)(C)C(C)(C)C	3593.1	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #26	CC(C)(C)[Si](C)(C)N=C1NC(COC(=O)N(O)[Si](C)(C)C(C)(C)C)C2N([Si](C)(C)C(C)(C)C)C(=N)NC23N1CCC3(O)O	3933.2	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #26	CC(C)(C)[Si](C)(C)N=C1NC(COC(=O)N(O)[Si](C)(C)C(C)(C)C)C2N([Si](C)(C)C(C)(C)C)C(=N)NC23N1CCC3(O)O	3708.1	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #27	CC(C)(C)[Si](C)(C)N=C1NC2C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)NC(=N[Si](C)(C)C(C)(C)C)N3CCC(O)(O)C23N1	3946.6	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #27	CC(C)(C)[Si](C)(C)N=C1NC2C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)NC(=N[Si](C)(C)C(C)(C)C)N3CCC(O)(O)C23N1	3667.5	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #28	CC(C)(C)[Si](C)(C)N=C1NC(COC(=O)N(O)[Si](C)(C)C(C)(C)C)C2NC(=N)N([Si](C)(C)C(C)(C)C)C23N1CCC3(O)O	3854.6	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #28	CC(C)(C)[Si](C)(C)N=C1NC(COC(=O)N(O)[Si](C)(C)C(C)(C)C)C2NC(=N)N([Si](C)(C)C(C)(C)C)C23N1CCC3(O)O	3683.8	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #29	CC(C)(C)[Si](C)(C)N(O)C(=O)OCC1NC(=N)N2CCC(O)(O)C23C1N([Si](C)(C)C(C)(C)C)C(=N)N3[Si](C)(C)C(C)(C)C	3789.5	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #29	CC(C)(C)[Si](C)(C)N(O)C(=O)OCC1NC(=N)N2CCC(O)(O)C23C1N([Si](C)(C)C(C)(C)C)C(=N)N3[Si](C)(C)C(C)(C)C	3690.3	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC1(O[Si](C)(C)C(C)(C)C)CCN2C(=N)NC(COC(=O)N(O)[Si](C)(C)C(C)(C)C)C3NC(=N)NC321	4003.0	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC1(O[Si](C)(C)C(C)(C)C)CCN2C(=N)NC(COC(=O)N(O)[Si](C)(C)C(C)(C)C)C3NC(=N)NC321	3561.7	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #30	CC(C)(C)[Si](C)(C)N=C1NC2C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)NC(=N)N3CCC(O)(O)C23N1[Si](C)(C)C(C)(C)C	3872.8	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #30	CC(C)(C)[Si](C)(C)N=C1NC2C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)NC(=N)N3CCC(O)(O)C23N1[Si](C)(C)C(C)(C)C	3629.9	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #31	CC(C)(C)[Si](C)(C)N=C1NC23C(C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)NC(=N)N2CCC3(O)O)N1[Si](C)(C)C(C)(C)C	3932.0	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #31	CC(C)(C)[Si](C)(C)N=C1NC23C(C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)NC(=N)N2CCC3(O)O)N1[Si](C)(C)C(C)(C)C	3678.2	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #32	CC(C)(C)[Si](C)(C)N=C1N2CCC(O)(O)C23C(NC(=N)N3[Si](C)(C)C(C)(C)C)C(COC(=O)NO)N1[Si](C)(C)C(C)(C)C	3828.5	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #32	CC(C)(C)[Si](C)(C)N=C1N2CCC(O)(O)C23C(NC(=N)N3[Si](C)(C)C(C)(C)C)C(COC(=O)NO)N1[Si](C)(C)C(C)(C)C	3635.8	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #33	CC(C)(C)[Si](C)(C)N=C1NC2C(COC(=O)NO)N([Si](C)(C)C(C)(C)C)C(=N[Si](C)(C)C(C)(C)C)N3CCC(O)(O)C23N1	3890.8	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #33	CC(C)(C)[Si](C)(C)N=C1NC2C(COC(=O)NO)N([Si](C)(C)C(C)(C)C)C(=N[Si](C)(C)C(C)(C)C)N3CCC(O)(O)C23N1	3608.2	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #34	CC(C)(C)[Si](C)(C)N=C1N2CCC(O)(O)C23NC(=N)N([Si](C)(C)C(C)(C)C)C3C(COC(=O)NO)N1[Si](C)(C)C(C)(C)C	3886.5	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #34	CC(C)(C)[Si](C)(C)N=C1N2CCC(O)(O)C23NC(=N)N([Si](C)(C)C(C)(C)C)C3C(COC(=O)NO)N1[Si](C)(C)C(C)(C)C	3652.9	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #35	CC(C)(C)[Si](C)(C)N1C(=N)N2CCC(O)(O)C23C(C1COC(=O)NO)N([Si](C)(C)C(C)(C)C)C(=N)N3[Si](C)(C)C(C)(C)C	3792.6	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #35	CC(C)(C)[Si](C)(C)N1C(=N)N2CCC(O)(O)C23C(C1COC(=O)NO)N([Si](C)(C)C(C)(C)C)C(=N)N3[Si](C)(C)C(C)(C)C	3752.0	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #36	CC(C)(C)[Si](C)(C)N=C1NC2C(COC(=O)NO)N([Si](C)(C)C(C)(C)C)C(=N)N3CCC(O)(O)C23N1[Si](C)(C)C(C)(C)C	3861.9	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #36	CC(C)(C)[Si](C)(C)N=C1NC2C(COC(=O)NO)N([Si](C)(C)C(C)(C)C)C(=N)N3CCC(O)(O)C23N1[Si](C)(C)C(C)(C)C	3684.4	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #37	CC(C)(C)[Si](C)(C)N=C1NC23C(C(COC(=O)NO)N([Si](C)(C)C(C)(C)C)C(=N)N2CCC3(O)O)N1[Si](C)(C)C(C)(C)C	3879.5	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #37	CC(C)(C)[Si](C)(C)N=C1NC23C(C(COC(=O)NO)N([Si](C)(C)C(C)(C)C)C(=N)N2CCC3(O)O)N1[Si](C)(C)C(C)(C)C	3714.9	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #38	CC(C)(C)[Si](C)(C)N=C1NC(COC(=O)NO)C2N([Si](C)(C)C(C)(C)C)C(=N[Si](C)(C)C(C)(C)C)NC23N1CCC3(O)O	3878.7	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #38	CC(C)(C)[Si](C)(C)N=C1NC(COC(=O)NO)C2N([Si](C)(C)C(C)(C)C)C(=N[Si](C)(C)C(C)(C)C)NC23N1CCC3(O)O	3628.8	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #39	CC(C)(C)[Si](C)(C)N=C1NC(COC(=O)NO)C2N([Si](C)(C)C(C)(C)C)C(=N)N([Si](C)(C)C(C)(C)C)C23N1CCC3(O)O	3767.6	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #39	CC(C)(C)[Si](C)(C)N=C1NC(COC(=O)NO)C2N([Si](C)(C)C(C)(C)C)C(=N)N([Si](C)(C)C(C)(C)C)C23N1CCC3(O)O	3726.0	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC1(O[Si](C)(C)C(C)(C)C)CCN2C(=N)NC(COC(=O)NO)C3N([Si](C)(C)C(C)(C)C)C(=N)NC321	3972.2	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC1(O[Si](C)(C)C(C)(C)C)CCN2C(=N)NC(COC(=O)NO)C3N([Si](C)(C)C(C)(C)C)C(=N)NC321	3615.3	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #40	CC(C)(C)[Si](C)(C)N=C1NC(COC(=O)NO)C2NC(=N[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)C23N1CCC3(O)O	3820.2	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #40	CC(C)(C)[Si](C)(C)N=C1NC(COC(=O)NO)C2NC(=N[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)C23N1CCC3(O)O	3614.8	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #41	CC(C)(C)[Si](C)(C)N=C1N([Si](C)(C)C(C)(C)C)C2C(COC(=O)NO)NC(=N)N3CCC(O)(O)C23N1[Si](C)(C)C(C)(C)C	3758.3	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #41	CC(C)(C)[Si](C)(C)N=C1N([Si](C)(C)C(C)(C)C)C2C(COC(=O)NO)NC(=N)N3CCC(O)(O)C23N1[Si](C)(C)C(C)(C)C	3563.4	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #5	CC(C)(C)[Si](C)(C)N=C1NC2C(COC(=O)NO)NC(=N)N3CCC(O[Si](C)(C)C(C)(C)C)(O[Si](C)(C)C(C)(C)C)C23N1	3940.2	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #5	CC(C)(C)[Si](C)(C)N=C1NC2C(COC(=O)NO)NC(=N)N3CCC(O[Si](C)(C)C(C)(C)C)(O[Si](C)(C)C(C)(C)C)C23N1	3585.9	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #6	CC(C)(C)[Si](C)(C)OC1(O[Si](C)(C)C(C)(C)C)CCN2C(=N)NC(COC(=O)NO)C3NC(=N)N([Si](C)(C)C(C)(C)C)C321	3956.9	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #6	CC(C)(C)[Si](C)(C)OC1(O[Si](C)(C)C(C)(C)C)CCN2C(=N)NC(COC(=O)NO)C3NC(=N)N([Si](C)(C)C(C)(C)C)C321	3600.6	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #7	CC(C)(C)[Si](C)(C)N=C1N2CCC(O)(O[Si](C)(C)C(C)(C)C)C23NC(=N)NC3C(COC(=O)NO)N1[Si](C)(C)C(C)(C)C	3919.7	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #7	CC(C)(C)[Si](C)(C)N=C1N2CCC(O)(O[Si](C)(C)C(C)(C)C)C23NC(=N)NC3C(COC(=O)NO)N1[Si](C)(C)C(C)(C)C	3548.7	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #8	CC(C)(C)[Si](C)(C)N=C1NC(COC(=O)N(O)[Si](C)(C)C(C)(C)C)C2NC(=N)NC23N1CCC3(O)O[Si](C)(C)C(C)(C)C	3944.6	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #8	CC(C)(C)[Si](C)(C)N=C1NC(COC(=O)N(O)[Si](C)(C)C(C)(C)C)C2NC(=N)NC23N1CCC3(O)O[Si](C)(C)C(C)(C)C	3597.8	Standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #9	CC(C)(C)[Si](C)(C)N=C1NC(COC(=O)NO)C2N([Si](C)(C)C(C)(C)C)C(=N)NC23N1CCC3(O)O[Si](C)(C)C(C)(C)C	3936.3	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,3TBDMS,isomer #9	CC(C)(C)[Si](C)(C)N=C1NC(COC(=O)NO)C2N([Si](C)(C)C(C)(C)C)C(=N)NC23N1CCC3(O)O[Si](C)(C)C(C)(C)C	3649.7	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #1	CC(C)(C)[Si](C)(C)N=C1N2CCC(O[Si](C)(C)C(C)(C)C)(O[Si](C)(C)C(C)(C)C)C23NC(=N)NC3C(COC(=O)NO)N1[Si](C)(C)C(C)(C)C	4016.9	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #1	CC(C)(C)[Si](C)(C)N=C1N2CCC(O[Si](C)(C)C(C)(C)C)(O[Si](C)(C)C(C)(C)C)C23NC(=N)NC3C(COC(=O)NO)N1[Si](C)(C)C(C)(C)C	3700.8	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #10	CC(C)(C)[Si](C)(C)OC1(O[Si](C)(C)C(C)(C)C)CCN2C(=N)NC(COC(=O)N(O)[Si](C)(C)C(C)(C)C)C3N([Si](C)(C)C(C)(C)C)C(=N)NC321	4053.1	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #10	CC(C)(C)[Si](C)(C)OC1(O[Si](C)(C)C(C)(C)C)CCN2C(=N)NC(COC(=O)N(O)[Si](C)(C)C(C)(C)C)C3N([Si](C)(C)C(C)(C)C)C(=N)NC321	3837.1	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #11	CC(C)(C)[Si](C)(C)N=C1NC2C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)NC(=N)N3CCC(O[Si](C)(C)C(C)(C)C)(O[Si](C)(C)C(C)(C)C)C23N1	4061.6	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #11	CC(C)(C)[Si](C)(C)N=C1NC2C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)NC(=N)N3CCC(O[Si](C)(C)C(C)(C)C)(O[Si](C)(C)C(C)(C)C)C23N1	3770.0	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #12	CC(C)(C)[Si](C)(C)OC1(O[Si](C)(C)C(C)(C)C)CCN2C(=N)NC(COC(=O)N(O)[Si](C)(C)C(C)(C)C)C3NC(=N)N([Si](C)(C)C(C)(C)C)C321	4026.4	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #12	CC(C)(C)[Si](C)(C)OC1(O[Si](C)(C)C(C)(C)C)CCN2C(=N)NC(COC(=O)N(O)[Si](C)(C)C(C)(C)C)C3NC(=N)N([Si](C)(C)C(C)(C)C)C321	3808.2	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #13	CC(C)(C)[Si](C)(C)N=C1NC23C(C(COC(=O)NO)NC(=N)N2CCC3(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)N1[Si](C)(C)C(C)(C)C	4013.8	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #13	CC(C)(C)[Si](C)(C)N=C1NC23C(C(COC(=O)NO)NC(=N)N2CCC3(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)N1[Si](C)(C)C(C)(C)C	3783.8	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #14	CC(C)(C)[Si](C)(C)OC1(O[Si](C)(C)C(C)(C)C)CCN2C(=N)NC(COC(=O)NO)C3N([Si](C)(C)C(C)(C)C)C(=N)N([Si](C)(C)C(C)(C)C)C321	3962.5	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #14	CC(C)(C)[Si](C)(C)OC1(O[Si](C)(C)C(C)(C)C)CCN2C(=N)NC(COC(=O)NO)C3N([Si](C)(C)C(C)(C)C)C(=N)N([Si](C)(C)C(C)(C)C)C321	3867.8	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #15	CC(C)(C)[Si](C)(C)N=C1NC2C(COC(=O)NO)NC(=N)N3CCC(O[Si](C)(C)C(C)(C)C)(O[Si](C)(C)C(C)(C)C)C23N1[Si](C)(C)C(C)(C)C	3981.7	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #15	CC(C)(C)[Si](C)(C)N=C1NC2C(COC(=O)NO)NC(=N)N3CCC(O[Si](C)(C)C(C)(C)C)(O[Si](C)(C)C(C)(C)C)C23N1[Si](C)(C)C(C)(C)C	3763.3	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #16	CC(C)(C)[Si](C)(C)N=C1N2CCC(O)(O[Si](C)(C)C(C)(C)C)C23C(NC(=N)N3[Si](C)(C)C(C)(C)C)C(COC(=O)NO)N1[Si](C)(C)C(C)(C)C	3960.2	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #16	CC(C)(C)[Si](C)(C)N=C1N2CCC(O)(O[Si](C)(C)C(C)(C)C)C23C(NC(=N)N3[Si](C)(C)C(C)(C)C)C(COC(=O)NO)N1[Si](C)(C)C(C)(C)C	3823.7	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #17	CC(C)(C)[Si](C)(C)N=C1NC2C(COC(=O)NO)N([Si](C)(C)C(C)(C)C)C(=N[Si](C)(C)C(C)(C)C)N3CCC(O)(O[Si](C)(C)C(C)(C)C)C23N1	4020.0	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #17	CC(C)(C)[Si](C)(C)N=C1NC2C(COC(=O)NO)N([Si](C)(C)C(C)(C)C)C(=N[Si](C)(C)C(C)(C)C)N3CCC(O)(O[Si](C)(C)C(C)(C)C)C23N1	3738.4	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #18	CC(C)(C)[Si](C)(C)N=C1N2CCC(O)(O[Si](C)(C)C(C)(C)C)C23NC(=N)N([Si](C)(C)C(C)(C)C)C3C(COC(=O)NO)N1[Si](C)(C)C(C)(C)C	3996.6	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #18	CC(C)(C)[Si](C)(C)N=C1N2CCC(O)(O[Si](C)(C)C(C)(C)C)C23NC(=N)N([Si](C)(C)C(C)(C)C)C3C(COC(=O)NO)N1[Si](C)(C)C(C)(C)C	3838.0	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #19	CC(C)(C)[Si](C)(C)N=C1N2CCC(O)(O[Si](C)(C)C(C)(C)C)C23NC(=N)NC3C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)N1[Si](C)(C)C(C)(C)C	4018.4	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #19	CC(C)(C)[Si](C)(C)N=C1N2CCC(O)(O[Si](C)(C)C(C)(C)C)C23NC(=N)NC3C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)N1[Si](C)(C)C(C)(C)C	3746.0	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #2	CC(C)(C)[Si](C)(C)N=C1NC(COC(=O)N(O)[Si](C)(C)C(C)(C)C)C2NC(=N)NC23N1CCC3(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	4034.8	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #2	CC(C)(C)[Si](C)(C)N=C1NC(COC(=O)N(O)[Si](C)(C)C(C)(C)C)C2NC(=N)NC23N1CCC3(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	3734.9	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #20	CC(C)(C)[Si](C)(C)N=C1NC(COC(=O)N(O)[Si](C)(C)C(C)(C)C)C2N([Si](C)(C)C(C)(C)C)C(=N)NC23N1CCC3(O)O[Si](C)(C)C(C)(C)C	4018.9	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #20	CC(C)(C)[Si](C)(C)N=C1NC(COC(=O)N(O)[Si](C)(C)C(C)(C)C)C2N([Si](C)(C)C(C)(C)C)C(=N)NC23N1CCC3(O)O[Si](C)(C)C(C)(C)C	3885.8	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #21	CC(C)(C)[Si](C)(C)N=C1NC2C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)NC(=N[Si](C)(C)C(C)(C)C)N3CCC(O)(O[Si](C)(C)C(C)(C)C)C23N1	4023.3	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #21	CC(C)(C)[Si](C)(C)N=C1NC2C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)NC(=N[Si](C)(C)C(C)(C)C)N3CCC(O)(O[Si](C)(C)C(C)(C)C)C23N1	3787.8	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #22	CC(C)(C)[Si](C)(C)N=C1NC(COC(=O)N(O)[Si](C)(C)C(C)(C)C)C2NC(=N)N([Si](C)(C)C(C)(C)C)C23N1CCC3(O)O[Si](C)(C)C(C)(C)C	3974.0	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #22	CC(C)(C)[Si](C)(C)N=C1NC(COC(=O)N(O)[Si](C)(C)C(C)(C)C)C2NC(=N)N([Si](C)(C)C(C)(C)C)C23N1CCC3(O)O[Si](C)(C)C(C)(C)C	3856.9	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #23	CC(C)(C)[Si](C)(C)N=C1NC(COC(=O)NO)C2N([Si](C)(C)C(C)(C)C)C(=N[Si](C)(C)C(C)(C)C)NC23N1CCC3(O)O[Si](C)(C)C(C)(C)C	4019.0	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #23	CC(C)(C)[Si](C)(C)N=C1NC(COC(=O)NO)C2N([Si](C)(C)C(C)(C)C)C(=N[Si](C)(C)C(C)(C)C)NC23N1CCC3(O)O[Si](C)(C)C(C)(C)C	3769.5	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #24	CC(C)(C)[Si](C)(C)N=C1NC(COC(=O)NO)C2N([Si](C)(C)C(C)(C)C)C(=N)N([Si](C)(C)C(C)(C)C)C23N1CCC3(O)O[Si](C)(C)C(C)(C)C	3924.8	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #24	CC(C)(C)[Si](C)(C)N=C1NC(COC(=O)NO)C2N([Si](C)(C)C(C)(C)C)C(=N)N([Si](C)(C)C(C)(C)C)C23N1CCC3(O)O[Si](C)(C)C(C)(C)C	3912.6	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #25	CC(C)(C)[Si](C)(C)N=C1NC(COC(=O)NO)C2NC(=N[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)C23N1CCC3(O)O[Si](C)(C)C(C)(C)C	3968.4	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #25	CC(C)(C)[Si](C)(C)N=C1NC(COC(=O)NO)C2NC(=N[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)C23N1CCC3(O)O[Si](C)(C)C(C)(C)C	3764.8	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #26	CC(C)(C)[Si](C)(C)OC1(O)CCN2C(=N)N([Si](C)(C)C(C)(C)C)C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)C3N([Si](C)(C)C(C)(C)C)C(=N)NC321	4031.0	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #26	CC(C)(C)[Si](C)(C)OC1(O)CCN2C(=N)N([Si](C)(C)C(C)(C)C)C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)C3N([Si](C)(C)C(C)(C)C)C(=N)NC321	3915.6	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #27	CC(C)(C)[Si](C)(C)N=C1NC2C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)C(=N)N3CCC(O)(O[Si](C)(C)C(C)(C)C)C23N1	4062.8	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #27	CC(C)(C)[Si](C)(C)N=C1NC2C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)C(=N)N3CCC(O)(O[Si](C)(C)C(C)(C)C)C23N1	3885.7	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #28	CC(C)(C)[Si](C)(C)OC1(O)CCN2C(=N)N([Si](C)(C)C(C)(C)C)C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)C3NC(=N)N([Si](C)(C)C(C)(C)C)C321	4020.1	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #28	CC(C)(C)[Si](C)(C)OC1(O)CCN2C(=N)N([Si](C)(C)C(C)(C)C)C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)C3NC(=N)N([Si](C)(C)C(C)(C)C)C321	3901.6	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #29	CC(C)(C)[Si](C)(C)N=C1NC23C(C(COC(=O)NO)N([Si](C)(C)C(C)(C)C)C(=N)N2CCC3(O)O[Si](C)(C)C(C)(C)C)N1[Si](C)(C)C(C)(C)C	4001.4	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #29	CC(C)(C)[Si](C)(C)N=C1NC23C(C(COC(=O)NO)N([Si](C)(C)C(C)(C)C)C(=N)N2CCC3(O)O[Si](C)(C)C(C)(C)C)N1[Si](C)(C)C(C)(C)C	3883.9	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #3	CC(C)(C)[Si](C)(C)N=C1NC(COC(=O)NO)C2N([Si](C)(C)C(C)(C)C)C(=N)NC23N1CCC3(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	4035.0	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #3	CC(C)(C)[Si](C)(C)N=C1NC(COC(=O)NO)C2N([Si](C)(C)C(C)(C)C)C(=N)NC23N1CCC3(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	3825.7	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #30	CC(C)(C)[Si](C)(C)OC1(O)CCN2C(=N)N([Si](C)(C)C(C)(C)C)C(COC(=O)NO)C3N([Si](C)(C)C(C)(C)C)C(=N)N([Si](C)(C)C(C)(C)C)C321	3946.8	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #30	CC(C)(C)[Si](C)(C)OC1(O)CCN2C(=N)N([Si](C)(C)C(C)(C)C)C(COC(=O)NO)C3N([Si](C)(C)C(C)(C)C)C(=N)N([Si](C)(C)C(C)(C)C)C321	3961.0	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #31	CC(C)(C)[Si](C)(C)N=C1NC2C(COC(=O)NO)N([Si](C)(C)C(C)(C)C)C(=N)N3CCC(O)(O[Si](C)(C)C(C)(C)C)C23N1[Si](C)(C)C(C)(C)C	4000.0	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #31	CC(C)(C)[Si](C)(C)N=C1NC2C(COC(=O)NO)N([Si](C)(C)C(C)(C)C)C(=N)N3CCC(O)(O[Si](C)(C)C(C)(C)C)C23N1[Si](C)(C)C(C)(C)C	3873.9	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #32	CC(C)(C)[Si](C)(C)N=C1NC23C(C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)NC(=N)N2CCC3(O)O[Si](C)(C)C(C)(C)C)N1[Si](C)(C)C(C)(C)C	4024.0	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #32	CC(C)(C)[Si](C)(C)N=C1NC23C(C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)NC(=N)N2CCC3(O)O[Si](C)(C)C(C)(C)C)N1[Si](C)(C)C(C)(C)C	3833.7	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #33	CC(C)(C)[Si](C)(C)OC1(O)CCN2C(=N)NC(COC(=O)N(O)[Si](C)(C)C(C)(C)C)C3N([Si](C)(C)C(C)(C)C)C(=N)N([Si](C)(C)C(C)(C)C)C321	3924.4	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #33	CC(C)(C)[Si](C)(C)OC1(O)CCN2C(=N)NC(COC(=O)N(O)[Si](C)(C)C(C)(C)C)C3N([Si](C)(C)C(C)(C)C)C(=N)N([Si](C)(C)C(C)(C)C)C321	3883.1	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #34	CC(C)(C)[Si](C)(C)N=C1NC2C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)NC(=N)N3CCC(O)(O[Si](C)(C)C(C)(C)C)C23N1[Si](C)(C)C(C)(C)C	3985.2	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #34	CC(C)(C)[Si](C)(C)N=C1NC2C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)NC(=N)N3CCC(O)(O[Si](C)(C)C(C)(C)C)C23N1[Si](C)(C)C(C)(C)C	3798.4	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #35	CC(C)(C)[Si](C)(C)N=C1N([Si](C)(C)C(C)(C)C)C2C(COC(=O)NO)NC(=N)N3CCC(O)(O[Si](C)(C)C(C)(C)C)C23N1[Si](C)(C)C(C)(C)C	3913.5	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #35	CC(C)(C)[Si](C)(C)N=C1N([Si](C)(C)C(C)(C)C)C2C(COC(=O)NO)NC(=N)N3CCC(O)(O[Si](C)(C)C(C)(C)C)C23N1[Si](C)(C)C(C)(C)C	3733.1	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #36	CC(C)(C)[Si](C)(C)N=C1NC23C(C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)C(=N)N2CCC3(O)O)N1[Si](C)(C)C(C)(C)C	4008.0	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #36	CC(C)(C)[Si](C)(C)N=C1NC23C(C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)C(=N)N2CCC3(O)O)N1[Si](C)(C)C(C)(C)C	3930.2	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #37	CC(C)(C)[Si](C)(C)N(O)C(=O)OCC1C2N([Si](C)(C)C(C)(C)C)C(=N)N([Si](C)(C)C(C)(C)C)C23N(CCC3(O)O)C(=N)N1[Si](C)(C)C(C)(C)C	3906.3	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #37	CC(C)(C)[Si](C)(C)N(O)C(=O)OCC1C2N([Si](C)(C)C(C)(C)C)C(=N)N([Si](C)(C)C(C)(C)C)C23N(CCC3(O)O)C(=N)N1[Si](C)(C)C(C)(C)C	3975.7	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #38	CC(C)(C)[Si](C)(C)N=C1N2CCC(O)(O)C23NC(=N)N([Si](C)(C)C(C)(C)C)C3C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)N1[Si](C)(C)C(C)(C)C	4007.5	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #38	CC(C)(C)[Si](C)(C)N=C1N2CCC(O)(O)C23NC(=N)N([Si](C)(C)C(C)(C)C)C3C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)N1[Si](C)(C)C(C)(C)C	3893.8	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #39	CC(C)(C)[Si](C)(C)N=C1NC2C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)C(=N[Si](C)(C)C(C)(C)C)N3CCC(O)(O)C23N1	4003.5	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #39	CC(C)(C)[Si](C)(C)N=C1NC2C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)C(=N[Si](C)(C)C(C)(C)C)N3CCC(O)(O)C23N1	3822.6	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #4	CC(C)(C)[Si](C)(C)N=C1NC2C(COC(=O)NO)NC(=N[Si](C)(C)C(C)(C)C)N3CCC(O[Si](C)(C)C(C)(C)C)(O[Si](C)(C)C(C)(C)C)C23N1	3995.4	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #4	CC(C)(C)[Si](C)(C)N=C1NC2C(COC(=O)NO)NC(=N[Si](C)(C)C(C)(C)C)N3CCC(O[Si](C)(C)C(C)(C)C)(O[Si](C)(C)C(C)(C)C)C23N1	3716.5	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #40	CC(C)(C)[Si](C)(C)N=C1NC2C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)C(=N)N3CCC(O)(O)C23N1[Si](C)(C)C(C)(C)C	3972.0	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #40	CC(C)(C)[Si](C)(C)N=C1NC2C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)C(=N)N3CCC(O)(O)C23N1[Si](C)(C)C(C)(C)C	3902.4	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #41	CC(C)(C)[Si](C)(C)N=C1N2CCC(O)(O)C23C(NC(=N)N3[Si](C)(C)C(C)(C)C)C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)N1[Si](C)(C)C(C)(C)C	3927.8	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #41	CC(C)(C)[Si](C)(C)N=C1N2CCC(O)(O)C23C(NC(=N)N3[Si](C)(C)C(C)(C)C)C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)N1[Si](C)(C)C(C)(C)C	3874.6	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #42	CC(C)(C)[Si](C)(C)N=C1NC(COC(=O)N(O)[Si](C)(C)C(C)(C)C)C2N([Si](C)(C)C(C)(C)C)C(=N[Si](C)(C)C(C)(C)C)NC23N1CCC3(O)O	4017.1	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #42	CC(C)(C)[Si](C)(C)N=C1NC(COC(=O)N(O)[Si](C)(C)C(C)(C)C)C2N([Si](C)(C)C(C)(C)C)C(=N[Si](C)(C)C(C)(C)C)NC23N1CCC3(O)O	3877.7	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #43	CC(C)(C)[Si](C)(C)N=C1NC(COC(=O)N(O)[Si](C)(C)C(C)(C)C)C2N([Si](C)(C)C(C)(C)C)C(=N)N([Si](C)(C)C(C)(C)C)C23N1CCC3(O)O	3876.9	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #43	CC(C)(C)[Si](C)(C)N=C1NC(COC(=O)N(O)[Si](C)(C)C(C)(C)C)C2N([Si](C)(C)C(C)(C)C)C(=N)N([Si](C)(C)C(C)(C)C)C23N1CCC3(O)O	3973.6	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #44	CC(C)(C)[Si](C)(C)N=C1NC(COC(=O)N(O)[Si](C)(C)C(C)(C)C)C2NC(=N[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)C23N1CCC3(O)O	3933.4	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #44	CC(C)(C)[Si](C)(C)N=C1NC(COC(=O)N(O)[Si](C)(C)C(C)(C)C)C2NC(=N[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)C23N1CCC3(O)O	3859.3	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #45	CC(C)(C)[Si](C)(C)N=C1N([Si](C)(C)C(C)(C)C)C2C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)NC(=N)N3CCC(O)(O)C23N1[Si](C)(C)C(C)(C)C	3862.8	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #45	CC(C)(C)[Si](C)(C)N=C1N([Si](C)(C)C(C)(C)C)C2C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)NC(=N)N3CCC(O)(O)C23N1[Si](C)(C)C(C)(C)C	3788.4	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #46	CC(C)(C)[Si](C)(C)N=C1N2CCC(O)(O)C23C(C(COC(=O)NO)N1[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)C(=N)N3[Si](C)(C)C(C)(C)C	3875.0	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #46	CC(C)(C)[Si](C)(C)N=C1N2CCC(O)(O)C23C(C(COC(=O)NO)N1[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)C(=N)N3[Si](C)(C)C(C)(C)C	3941.0	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #47	CC(C)(C)[Si](C)(C)N=C1N2CCC(O)(O)C23C(NC(=N[Si](C)(C)C(C)(C)C)N3[Si](C)(C)C(C)(C)C)C(COC(=O)NO)N1[Si](C)(C)C(C)(C)C	3918.0	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #47	CC(C)(C)[Si](C)(C)N=C1N2CCC(O)(O)C23C(NC(=N[Si](C)(C)C(C)(C)C)N3[Si](C)(C)C(C)(C)C)C(COC(=O)NO)N1[Si](C)(C)C(C)(C)C	3820.8	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #48	CC(C)(C)[Si](C)(C)N=C1N2CCC(O)(O)C23NC(=N[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)C3C(COC(=O)NO)N1[Si](C)(C)C(C)(C)C	3983.0	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #48	CC(C)(C)[Si](C)(C)N=C1N2CCC(O)(O)C23NC(=N[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)C3C(COC(=O)NO)N1[Si](C)(C)C(C)(C)C	3828.6	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #49	CC(C)(C)[Si](C)(C)N=C1N([Si](C)(C)C(C)(C)C)C2C(COC(=O)NO)N([Si](C)(C)C(C)(C)C)C(=N)N3CCC(O)(O)C23N1[Si](C)(C)C(C)(C)C	3885.8	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #49	CC(C)(C)[Si](C)(C)N=C1N([Si](C)(C)C(C)(C)C)C2C(COC(=O)NO)N([Si](C)(C)C(C)(C)C)C(=N)N3CCC(O)(O)C23N1[Si](C)(C)C(C)(C)C	3874.7	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #5	CC(C)(C)[Si](C)(C)N=C1NC(COC(=O)NO)C2NC(=N)N([Si](C)(C)C(C)(C)C)C23N1CCC3(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	3994.2	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #5	CC(C)(C)[Si](C)(C)N=C1NC(COC(=O)NO)C2NC(=N)N([Si](C)(C)C(C)(C)C)C23N1CCC3(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	3800.6	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #50	CC(C)(C)[Si](C)(C)N=C1NC(COC(=O)NO)C2N([Si](C)(C)C(C)(C)C)C(=N[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)C23N1CCC3(O)O	3867.3	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #50	CC(C)(C)[Si](C)(C)N=C1NC(COC(=O)NO)C2N([Si](C)(C)C(C)(C)C)C(=N[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)C23N1CCC3(O)O	3778.4	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #6	CC(C)(C)[Si](C)(C)OC1(O[Si](C)(C)C(C)(C)C)CCN2C(=N)N([Si](C)(C)C(C)(C)C)C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)C3NC(=N)NC321	4058.5	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #6	CC(C)(C)[Si](C)(C)OC1(O[Si](C)(C)C(C)(C)C)CCN2C(=N)N([Si](C)(C)C(C)(C)C)C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)C3NC(=N)NC321	3823.8	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #7	CC(C)(C)[Si](C)(C)OC1(O[Si](C)(C)C(C)(C)C)CCN2C(=N)N([Si](C)(C)C(C)(C)C)C(COC(=O)NO)C3N([Si](C)(C)C(C)(C)C)C(=N)NC321	4043.1	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #7	CC(C)(C)[Si](C)(C)OC1(O[Si](C)(C)C(C)(C)C)CCN2C(=N)N([Si](C)(C)C(C)(C)C)C(COC(=O)NO)C3N([Si](C)(C)C(C)(C)C)C(=N)NC321	3891.5	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #8	CC(C)(C)[Si](C)(C)N=C1NC2C(COC(=O)NO)N([Si](C)(C)C(C)(C)C)C(=N)N3CCC(O[Si](C)(C)C(C)(C)C)(O[Si](C)(C)C(C)(C)C)C23N1	4040.0	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #8	CC(C)(C)[Si](C)(C)N=C1NC2C(COC(=O)NO)N([Si](C)(C)C(C)(C)C)C(=N)N3CCC(O[Si](C)(C)C(C)(C)C)(O[Si](C)(C)C(C)(C)C)C23N1	3841.9	Standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #9	CC(C)(C)[Si](C)(C)OC1(O[Si](C)(C)C(C)(C)C)CCN2C(=N)N([Si](C)(C)C(C)(C)C)C(COC(=O)NO)C3NC(=N)N([Si](C)(C)C(C)(C)C)C321	4026.0	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,4TBDMS,isomer #9	CC(C)(C)[Si](C)(C)OC1(O[Si](C)(C)C(C)(C)C)CCN2C(=N)N([Si](C)(C)C(C)(C)C)C(COC(=O)NO)C3NC(=N)N([Si](C)(C)C(C)(C)C)C321	3896.1	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #1	CC(C)(C)[Si](C)(C)N=C1N2CCC(O[Si](C)(C)C(C)(C)C)(O[Si](C)(C)C(C)(C)C)C23C(NC(=N)N3[Si](C)(C)C(C)(C)C)C(COC(=O)NO)N1[Si](C)(C)C(C)(C)C	4080.8	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #1	CC(C)(C)[Si](C)(C)N=C1N2CCC(O[Si](C)(C)C(C)(C)C)(O[Si](C)(C)C(C)(C)C)C23C(NC(=N)N3[Si](C)(C)C(C)(C)C)C(COC(=O)NO)N1[Si](C)(C)C(C)(C)C	3955.1	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #10	CC(C)(C)[Si](C)(C)N=C1NC(COC(=O)NO)C2NC(=N[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)C23N1CCC3(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	4065.3	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #10	CC(C)(C)[Si](C)(C)N=C1NC(COC(=O)NO)C2NC(=N[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)C23N1CCC3(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	3897.8	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #11	CC(C)(C)[Si](C)(C)OC1(O[Si](C)(C)C(C)(C)C)CCN2C(=N)N([Si](C)(C)C(C)(C)C)C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)C3N([Si](C)(C)C(C)(C)C)C(=N)NC321	4133.3	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #11	CC(C)(C)[Si](C)(C)OC1(O[Si](C)(C)C(C)(C)C)CCN2C(=N)N([Si](C)(C)C(C)(C)C)C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)C3N([Si](C)(C)C(C)(C)C)C(=N)NC321	4098.8	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #12	CC(C)(C)[Si](C)(C)N=C1NC2C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)C(=N)N3CCC(O[Si](C)(C)C(C)(C)C)(O[Si](C)(C)C(C)(C)C)C23N1	4133.8	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #12	CC(C)(C)[Si](C)(C)N=C1NC2C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)C(=N)N3CCC(O[Si](C)(C)C(C)(C)C)(O[Si](C)(C)C(C)(C)C)C23N1	4007.3	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #13	CC(C)(C)[Si](C)(C)OC1(O[Si](C)(C)C(C)(C)C)CCN2C(=N)N([Si](C)(C)C(C)(C)C)C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)C3NC(=N)N([Si](C)(C)C(C)(C)C)C321	4120.1	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #13	CC(C)(C)[Si](C)(C)OC1(O[Si](C)(C)C(C)(C)C)CCN2C(=N)N([Si](C)(C)C(C)(C)C)C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)C3NC(=N)N([Si](C)(C)C(C)(C)C)C321	4079.2	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #14	CC(C)(C)[Si](C)(C)N=C1NC23C(C(COC(=O)NO)N([Si](C)(C)C(C)(C)C)C(=N)N2CCC3(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)N1[Si](C)(C)C(C)(C)C	4096.9	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #14	CC(C)(C)[Si](C)(C)N=C1NC23C(C(COC(=O)NO)N([Si](C)(C)C(C)(C)C)C(=N)N2CCC3(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)N1[Si](C)(C)C(C)(C)C	4036.3	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #15	CC(C)(C)[Si](C)(C)OC1(O[Si](C)(C)C(C)(C)C)CCN2C(=N)N([Si](C)(C)C(C)(C)C)C(COC(=O)NO)C3N([Si](C)(C)C(C)(C)C)C(=N)N([Si](C)(C)C(C)(C)C)C321	4085.6	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #15	CC(C)(C)[Si](C)(C)OC1(O[Si](C)(C)C(C)(C)C)CCN2C(=N)N([Si](C)(C)C(C)(C)C)C(COC(=O)NO)C3N([Si](C)(C)C(C)(C)C)C(=N)N([Si](C)(C)C(C)(C)C)C321	4153.7	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #16	CC(C)(C)[Si](C)(C)N=C1NC2C(COC(=O)NO)N([Si](C)(C)C(C)(C)C)C(=N)N3CCC(O[Si](C)(C)C(C)(C)C)(O[Si](C)(C)C(C)(C)C)C23N1[Si](C)(C)C(C)(C)C	4100.6	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #16	CC(C)(C)[Si](C)(C)N=C1NC2C(COC(=O)NO)N([Si](C)(C)C(C)(C)C)C(=N)N3CCC(O[Si](C)(C)C(C)(C)C)(O[Si](C)(C)C(C)(C)C)C23N1[Si](C)(C)C(C)(C)C	4033.3	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #17	CC(C)(C)[Si](C)(C)N=C1NC23C(C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)NC(=N)N2CCC3(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)N1[Si](C)(C)C(C)(C)C	4108.8	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #17	CC(C)(C)[Si](C)(C)N=C1NC23C(C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)NC(=N)N2CCC3(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)N1[Si](C)(C)C(C)(C)C	3948.7	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #18	CC(C)(C)[Si](C)(C)OC1(O[Si](C)(C)C(C)(C)C)CCN2C(=N)NC(COC(=O)N(O)[Si](C)(C)C(C)(C)C)C3N([Si](C)(C)C(C)(C)C)C(=N)N([Si](C)(C)C(C)(C)C)C321	4053.1	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #18	CC(C)(C)[Si](C)(C)OC1(O[Si](C)(C)C(C)(C)C)CCN2C(=N)NC(COC(=O)N(O)[Si](C)(C)C(C)(C)C)C3N([Si](C)(C)C(C)(C)C)C(=N)N([Si](C)(C)C(C)(C)C)C321	4060.7	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #19	CC(C)(C)[Si](C)(C)N=C1NC2C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)NC(=N)N3CCC(O[Si](C)(C)C(C)(C)C)(O[Si](C)(C)C(C)(C)C)C23N1[Si](C)(C)C(C)(C)C	4078.2	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #19	CC(C)(C)[Si](C)(C)N=C1NC2C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)NC(=N)N3CCC(O[Si](C)(C)C(C)(C)C)(O[Si](C)(C)C(C)(C)C)C23N1[Si](C)(C)C(C)(C)C	3930.8	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #2	CC(C)(C)[Si](C)(C)N=C1NC2C(COC(=O)NO)N([Si](C)(C)C(C)(C)C)C(=N[Si](C)(C)C(C)(C)C)N3CCC(O[Si](C)(C)C(C)(C)C)(O[Si](C)(C)C(C)(C)C)C23N1	4086.4	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #2	CC(C)(C)[Si](C)(C)N=C1NC2C(COC(=O)NO)N([Si](C)(C)C(C)(C)C)C(=N[Si](C)(C)C(C)(C)C)N3CCC(O[Si](C)(C)C(C)(C)C)(O[Si](C)(C)C(C)(C)C)C23N1	3859.9	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #20	CC(C)(C)[Si](C)(C)N=C1N([Si](C)(C)C(C)(C)C)C2C(COC(=O)NO)NC(=N)N3CCC(O[Si](C)(C)C(C)(C)C)(O[Si](C)(C)C(C)(C)C)C23N1[Si](C)(C)C(C)(C)C	4046.0	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #20	CC(C)(C)[Si](C)(C)N=C1N([Si](C)(C)C(C)(C)C)C2C(COC(=O)NO)NC(=N)N3CCC(O[Si](C)(C)C(C)(C)C)(O[Si](C)(C)C(C)(C)C)C23N1[Si](C)(C)C(C)(C)C	3896.9	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #21	CC(C)(C)[Si](C)(C)N=C1N2CCC(O)(O[Si](C)(C)C(C)(C)C)C23C(C(COC(=O)NO)N1[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)C(=N)N3[Si](C)(C)C(C)(C)C	4026.3	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #21	CC(C)(C)[Si](C)(C)N=C1N2CCC(O)(O[Si](C)(C)C(C)(C)C)C23C(C(COC(=O)NO)N1[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)C(=N)N3[Si](C)(C)C(C)(C)C	4088.4	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #22	CC(C)(C)[Si](C)(C)N=C1N2CCC(O)(O[Si](C)(C)C(C)(C)C)C23C(NC(=N[Si](C)(C)C(C)(C)C)N3[Si](C)(C)C(C)(C)C)C(COC(=O)NO)N1[Si](C)(C)C(C)(C)C	4065.9	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #22	CC(C)(C)[Si](C)(C)N=C1N2CCC(O)(O[Si](C)(C)C(C)(C)C)C23C(NC(=N[Si](C)(C)C(C)(C)C)N3[Si](C)(C)C(C)(C)C)C(COC(=O)NO)N1[Si](C)(C)C(C)(C)C	3921.3	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #23	CC(C)(C)[Si](C)(C)N=C1N2CCC(O)(O[Si](C)(C)C(C)(C)C)C23C(NC(=N)N3[Si](C)(C)C(C)(C)C)C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)N1[Si](C)(C)C(C)(C)C	4054.3	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #23	CC(C)(C)[Si](C)(C)N=C1N2CCC(O)(O[Si](C)(C)C(C)(C)C)C23C(NC(=N)N3[Si](C)(C)C(C)(C)C)C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)N1[Si](C)(C)C(C)(C)C	4001.9	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #24	CC(C)(C)[Si](C)(C)N=C1N2CCC(O)(O[Si](C)(C)C(C)(C)C)C23NC(=N[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)C3C(COC(=O)NO)N1[Si](C)(C)C(C)(C)C	4104.8	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #24	CC(C)(C)[Si](C)(C)N=C1N2CCC(O)(O[Si](C)(C)C(C)(C)C)C23NC(=N[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)C3C(COC(=O)NO)N1[Si](C)(C)C(C)(C)C	3932.7	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #25	CC(C)(C)[Si](C)(C)N=C1NC2C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)C(=N[Si](C)(C)C(C)(C)C)N3CCC(O)(O[Si](C)(C)C(C)(C)C)C23N1	4098.2	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #25	CC(C)(C)[Si](C)(C)N=C1NC2C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)C(=N[Si](C)(C)C(C)(C)C)N3CCC(O)(O[Si](C)(C)C(C)(C)C)C23N1	3914.2	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #26	CC(C)(C)[Si](C)(C)N=C1N2CCC(O)(O[Si](C)(C)C(C)(C)C)C23NC(=N)N([Si](C)(C)C(C)(C)C)C3C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)N1[Si](C)(C)C(C)(C)C	4092.5	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #26	CC(C)(C)[Si](C)(C)N=C1N2CCC(O)(O[Si](C)(C)C(C)(C)C)C23NC(=N)N([Si](C)(C)C(C)(C)C)C3C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)N1[Si](C)(C)C(C)(C)C	4031.4	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #27	CC(C)(C)[Si](C)(C)N=C1NC(COC(=O)N(O)[Si](C)(C)C(C)(C)C)C2N([Si](C)(C)C(C)(C)C)C(=N[Si](C)(C)C(C)(C)C)NC23N1CCC3(O)O[Si](C)(C)C(C)(C)C	4110.0	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #27	CC(C)(C)[Si](C)(C)N=C1NC(COC(=O)N(O)[Si](C)(C)C(C)(C)C)C2N([Si](C)(C)C(C)(C)C)C(=N[Si](C)(C)C(C)(C)C)NC23N1CCC3(O)O[Si](C)(C)C(C)(C)C	3959.9	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #28	CC(C)(C)[Si](C)(C)N=C1NC(COC(=O)N(O)[Si](C)(C)C(C)(C)C)C2N([Si](C)(C)C(C)(C)C)C(=N)N([Si](C)(C)C(C)(C)C)C23N1CCC3(O)O[Si](C)(C)C(C)(C)C	4011.3	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #28	CC(C)(C)[Si](C)(C)N=C1NC(COC(=O)N(O)[Si](C)(C)C(C)(C)C)C2N([Si](C)(C)C(C)(C)C)C(=N)N([Si](C)(C)C(C)(C)C)C23N1CCC3(O)O[Si](C)(C)C(C)(C)C	4111.4	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #29	CC(C)(C)[Si](C)(C)N=C1NC(COC(=O)N(O)[Si](C)(C)C(C)(C)C)C2NC(=N[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)C23N1CCC3(O)O[Si](C)(C)C(C)(C)C	4062.7	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #29	CC(C)(C)[Si](C)(C)N=C1NC(COC(=O)N(O)[Si](C)(C)C(C)(C)C)C2NC(=N[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)C23N1CCC3(O)O[Si](C)(C)C(C)(C)C	3947.1	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #3	CC(C)(C)[Si](C)(C)N=C1N2CCC(O[Si](C)(C)C(C)(C)C)(O[Si](C)(C)C(C)(C)C)C23NC(=N)N([Si](C)(C)C(C)(C)C)C3C(COC(=O)NO)N1[Si](C)(C)C(C)(C)C	4108.0	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #3	CC(C)(C)[Si](C)(C)N=C1N2CCC(O[Si](C)(C)C(C)(C)C)(O[Si](C)(C)C(C)(C)C)C23NC(=N)N([Si](C)(C)C(C)(C)C)C3C(COC(=O)NO)N1[Si](C)(C)C(C)(C)C	3980.0	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #30	CC(C)(C)[Si](C)(C)N=C1NC(COC(=O)NO)C2N([Si](C)(C)C(C)(C)C)C(=N[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)C23N1CCC3(O)O[Si](C)(C)C(C)(C)C	4023.8	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #30	CC(C)(C)[Si](C)(C)N=C1NC(COC(=O)NO)C2N([Si](C)(C)C(C)(C)C)C(=N[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)C23N1CCC3(O)O[Si](C)(C)C(C)(C)C	3866.4	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #31	CC(C)(C)[Si](C)(C)N=C1NC23C(C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)C(=N)N2CCC3(O)O[Si](C)(C)C(C)(C)C)N1[Si](C)(C)C(C)(C)C	4100.6	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #31	CC(C)(C)[Si](C)(C)N=C1NC23C(C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)C(=N)N2CCC3(O)O[Si](C)(C)C(C)(C)C)N1[Si](C)(C)C(C)(C)C	4065.7	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #32	CC(C)(C)[Si](C)(C)OC1(O)CCN2C(=N)N([Si](C)(C)C(C)(C)C)C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)C3N([Si](C)(C)C(C)(C)C)C(=N)N([Si](C)(C)C(C)(C)C)C321	4047.5	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #32	CC(C)(C)[Si](C)(C)OC1(O)CCN2C(=N)N([Si](C)(C)C(C)(C)C)C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)C3N([Si](C)(C)C(C)(C)C)C(=N)N([Si](C)(C)C(C)(C)C)C321	4165.7	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #33	CC(C)(C)[Si](C)(C)N=C1NC2C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)C(=N)N3CCC(O)(O[Si](C)(C)C(C)(C)C)C23N1[Si](C)(C)C(C)(C)C	4095.1	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #33	CC(C)(C)[Si](C)(C)N=C1NC2C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)C(=N)N3CCC(O)(O[Si](C)(C)C(C)(C)C)C23N1[Si](C)(C)C(C)(C)C	4054.2	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #34	CC(C)(C)[Si](C)(C)N=C1N([Si](C)(C)C(C)(C)C)C2C(COC(=O)NO)N([Si](C)(C)C(C)(C)C)C(=N)N3CCC(O)(O[Si](C)(C)C(C)(C)C)C23N1[Si](C)(C)C(C)(C)C	4040.8	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #34	CC(C)(C)[Si](C)(C)N=C1N([Si](C)(C)C(C)(C)C)C2C(COC(=O)NO)N([Si](C)(C)C(C)(C)C)C(=N)N3CCC(O)(O[Si](C)(C)C(C)(C)C)C23N1[Si](C)(C)C(C)(C)C	4039.6	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #35	CC(C)(C)[Si](C)(C)N=C1N([Si](C)(C)C(C)(C)C)C2C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)NC(=N)N3CCC(O)(O[Si](C)(C)C(C)(C)C)C23N1[Si](C)(C)C(C)(C)C	4012.4	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #35	CC(C)(C)[Si](C)(C)N=C1N([Si](C)(C)C(C)(C)C)C2C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)NC(=N)N3CCC(O)(O[Si](C)(C)C(C)(C)C)C23N1[Si](C)(C)C(C)(C)C	3943.1	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #36	CC(C)(C)[Si](C)(C)N=C1N([Si](C)(C)C(C)(C)C)C2C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)C(=N)N3CCC(O)(O)C23N1[Si](C)(C)C(C)(C)C	4014.0	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #36	CC(C)(C)[Si](C)(C)N=C1N([Si](C)(C)C(C)(C)C)C2C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)C(=N)N3CCC(O)(O)C23N1[Si](C)(C)C(C)(C)C	4082.2	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #37	CC(C)(C)[Si](C)(C)N=C1N2CCC(O)(O)C23NC(=N[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)C3C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)N1[Si](C)(C)C(C)(C)C	4110.2	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #37	CC(C)(C)[Si](C)(C)N=C1N2CCC(O)(O)C23NC(=N[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)C3C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)N1[Si](C)(C)C(C)(C)C	4011.4	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #38	CC(C)(C)[Si](C)(C)N=C1N2CCC(O)(O)C23C(C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)N1[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)C(=N)N3[Si](C)(C)C(C)(C)C	4006.6	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #38	CC(C)(C)[Si](C)(C)N=C1N2CCC(O)(O)C23C(C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)N1[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)C(=N)N3[Si](C)(C)C(C)(C)C	4151.2	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #39	CC(C)(C)[Si](C)(C)N=C1N2CCC(O)(O)C23C(NC(=N[Si](C)(C)C(C)(C)C)N3[Si](C)(C)C(C)(C)C)C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)N1[Si](C)(C)C(C)(C)C	4038.9	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #39	CC(C)(C)[Si](C)(C)N=C1N2CCC(O)(O)C23C(NC(=N[Si](C)(C)C(C)(C)C)N3[Si](C)(C)C(C)(C)C)C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)N1[Si](C)(C)C(C)(C)C	4009.2	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #4	CC(C)(C)[Si](C)(C)N=C1N2CCC(O[Si](C)(C)C(C)(C)C)(O[Si](C)(C)C(C)(C)C)C23NC(=N)NC3C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)N1[Si](C)(C)C(C)(C)C	4099.1	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #4	CC(C)(C)[Si](C)(C)N=C1N2CCC(O[Si](C)(C)C(C)(C)C)(O[Si](C)(C)C(C)(C)C)C23NC(=N)NC3C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)N1[Si](C)(C)C(C)(C)C	3889.0	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #40	CC(C)(C)[Si](C)(C)N=C1NC(COC(=O)N(O)[Si](C)(C)C(C)(C)C)C2N([Si](C)(C)C(C)(C)C)C(=N[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)C23N1CCC3(O)O	3991.0	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #40	CC(C)(C)[Si](C)(C)N=C1NC(COC(=O)N(O)[Si](C)(C)C(C)(C)C)C2N([Si](C)(C)C(C)(C)C)C(=N[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)C23N1CCC3(O)O	3985.6	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #41	CC(C)(C)[Si](C)(C)N=C1N2CCC(O)(O)C23C(C(COC(=O)NO)N1[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)C(=N[Si](C)(C)C(C)(C)C)N3[Si](C)(C)C(C)(C)C	4014.9	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #41	CC(C)(C)[Si](C)(C)N=C1N2CCC(O)(O)C23C(C(COC(=O)NO)N1[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)C(=N[Si](C)(C)C(C)(C)C)N3[Si](C)(C)C(C)(C)C	3964.8	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #5	CC(C)(C)[Si](C)(C)N=C1NC(COC(=O)N(O)[Si](C)(C)C(C)(C)C)C2N([Si](C)(C)C(C)(C)C)C(=N)NC23N1CCC3(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	4105.4	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #5	CC(C)(C)[Si](C)(C)N=C1NC(COC(=O)N(O)[Si](C)(C)C(C)(C)C)C2N([Si](C)(C)C(C)(C)C)C(=N)NC23N1CCC3(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	4012.4	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #6	CC(C)(C)[Si](C)(C)N=C1NC2C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)NC(=N[Si](C)(C)C(C)(C)C)N3CCC(O[Si](C)(C)C(C)(C)C)(O[Si](C)(C)C(C)(C)C)C23N1	4102.9	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #6	CC(C)(C)[Si](C)(C)N=C1NC2C(COC(=O)N(O)[Si](C)(C)C(C)(C)C)NC(=N[Si](C)(C)C(C)(C)C)N3CCC(O[Si](C)(C)C(C)(C)C)(O[Si](C)(C)C(C)(C)C)C23N1	3883.7	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #7	CC(C)(C)[Si](C)(C)N=C1NC(COC(=O)N(O)[Si](C)(C)C(C)(C)C)C2NC(=N)N([Si](C)(C)C(C)(C)C)C23N1CCC3(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	4073.5	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #7	CC(C)(C)[Si](C)(C)N=C1NC(COC(=O)N(O)[Si](C)(C)C(C)(C)C)C2NC(=N)N([Si](C)(C)C(C)(C)C)C23N1CCC3(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	3968.2	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #8	CC(C)(C)[Si](C)(C)N=C1NC(COC(=O)NO)C2N([Si](C)(C)C(C)(C)C)C(=N[Si](C)(C)C(C)(C)C)NC23N1CCC3(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	4096.6	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #8	CC(C)(C)[Si](C)(C)N=C1NC(COC(=O)NO)C2N([Si](C)(C)C(C)(C)C)C(=N[Si](C)(C)C(C)(C)C)NC23N1CCC3(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	3908.4	Standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #9	CC(C)(C)[Si](C)(C)N=C1NC(COC(=O)NO)C2N([Si](C)(C)C(C)(C)C)C(=N)N([Si](C)(C)C(C)(C)C)C23N1CCC3(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	4054.8	Semi standard non polar	33892256
N'-Hydroxysaxitoxin,5TBDMS,isomer #9	CC(C)(C)[Si](C)(C)N=C1NC(COC(=O)NO)C2N([Si](C)(C)C(C)(C)C)C(=N)N([Si](C)(C)C(C)(C)C)C23N1CCC3(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	4053.0	Standard non polar	33892256

Spectra

GC-MS Spectra

Spectrum Type	Description	Splash Key	Deposition Date	Source	View
Predicted GC-MS	Predicted GC-MS Spectrum - N'-Hydroxysaxitoxin GC-MS (Non-derivatized) - 70eV, Positive	splash10-06vi-9270000000-f253a6330423f3a9c0a0	2017-09-01	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - N'-Hydroxysaxitoxin GC-MS (2 TMS) - 70eV, Positive	splash10-00ui-9013100000-fcc7acd46c3ba898c8aa	2017-10-06	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - N'-Hydroxysaxitoxin GC-MS (Non-derivatized) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - N'-Hydroxysaxitoxin 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 - N'-Hydroxysaxitoxin 10V, Positive-QTOF	splash10-014j-4097000000-9bdf1b348fc1f2032a73	2016-06-03	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - N'-Hydroxysaxitoxin 20V, Positive-QTOF	splash10-01p9-3090000000-b9898e67ab43e966c423	2016-06-03	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - N'-Hydroxysaxitoxin 40V, Positive-QTOF	splash10-01ot-9020000000-be075ccb72d73c136340	2016-06-03	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - N'-Hydroxysaxitoxin 10V, Negative-QTOF	splash10-0a4i-9032000000-836ddf6f82fae70de37c	2016-08-04	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - N'-Hydroxysaxitoxin 20V, Negative-QTOF	splash10-0a4i-9010000000-f8257655ae4eae5acd7e	2016-08-04	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - N'-Hydroxysaxitoxin 40V, Negative-QTOF	splash10-0a4i-9010000000-f3979574061cd55c28a5	2016-08-04	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - N'-Hydroxysaxitoxin 10V, Positive-QTOF	splash10-014i-0009000000-2c801797f62113e0c538	2021-09-22	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - N'-Hydroxysaxitoxin 20V, Positive-QTOF	splash10-014r-0097000000-1a5f29c7337f7a5b2585	2021-09-22	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - N'-Hydroxysaxitoxin 40V, Positive-QTOF	splash10-0079-0090000000-621dc1a6b4f3a7df575a	2021-09-22	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - N'-Hydroxysaxitoxin 10V, Negative-QTOF	splash10-0bt9-1096000000-e4296a627f3904aec796	2021-09-22	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - N'-Hydroxysaxitoxin 20V, Negative-QTOF	splash10-056r-9010000000-b628a53e196042adc35e	2021-09-22	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - N'-Hydroxysaxitoxin 40V, Negative-QTOF	splash10-006x-9340000000-919c5db5be6d08bc5bd6	2021-09-22	Wishart Lab	View Spectrum

NMR Spectra

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

Biological Properties

Cellular Locations

Cytoplasm
Extracellular

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

FDB011767

KNApSAcK ID

Not Available

Chemspider ID

35013655

KEGG Compound ID

Not Available

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Not Available

METLIN ID

Not Available

PubChem Compound

75039120

PDB ID

Not Available

ChEBI ID

174292

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

(). Yannai, Shmuel. (2004) Dictionary of food compounds with CD-ROM: Additives, flavors, and ingredients. Boca Raton: Chapman & Hall/CRC.. .

Showing metabocard for N'-Hydroxysaxitoxin (HMDB0033664)

MOL for HMDB0033664 (N'-Hydroxysaxitoxin)

3D MOL for HMDB0033664 (N'-Hydroxysaxitoxin)

3D SDF for HMDB0033664 (N'-Hydroxysaxitoxin)

3D-SDF for HMDB0033664 (N'-Hydroxysaxitoxin)

PDB for HMDB0033664 (N'-Hydroxysaxitoxin)

3D PDB for HMDB0033664 (N'-Hydroxysaxitoxin)

SMILES for HMDB0033664 (N'-Hydroxysaxitoxin)

INCHI for HMDB0033664 (N'-Hydroxysaxitoxin)

Structure for HMDB0033664 (N'-Hydroxysaxitoxin)

3D Structure for HMDB0033664 (N'-Hydroxysaxitoxin)

Predicted Collision Cross Sections

Predicted Kovats Retention Indices

Underivatized

Derivatized

GC-MS Spectra

MS/MS Spectra

NMR Spectra