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Record Information

Version

5.0

Status

Detected but not Quantified

Creation Date

2021-09-11 21:34:48 UTC

Update Date

2021-09-26 23:16:29 UTC

HMDB ID

HMDB0259122

Secondary Accession Numbers

None

Metabolite Identification

Common Name

Tresperimus

Description

Tresperimus belongs to the class of organic compounds known as carbamate esters. Carbamate esters are compounds containing an ester of carbamic acid with the general structure R2NC(=O)OR' (R' not H). They are esters of carbamic acids. Based on a literature review very few articles have been published on Tresperimus. This compound has been identified in human blood as reported by (PMID: 31557052 ). Tresperimus is not a naturally occurring metabolite and is only found in those individuals exposed to this compound or its derivatives. Technically Tresperimus is part of the human exposome. The exposome can be defined as the collection of all the exposures of an individual in a lifetime and how those exposures relate to health. An individual's exposure begins before birth and includes insults from environmental and occupational sources.

Structure

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

  Mrv1652309112123352D          

 27 26  0  0  0  0            999 V2000
   12.5664    6.4302    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8520    6.8427    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1375    6.4302    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4230    6.8427    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7086    6.4302    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.9941    6.8427    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2796    6.4302    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.9941    7.6677    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   13.2809    6.8427    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9954    6.4302    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7099    6.8427    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   15.4243    6.4302    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.4243    5.6052    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.1388    6.8427    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.8533    6.4302    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.5677    6.8427    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.5677    7.6677    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.2822    6.4302    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   18.9967    6.8427    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.7112    6.4302    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.4256    6.8427    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.1401    6.4302    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.8546    6.8427    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   22.5690    6.4302    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.2835    6.8427    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.9980    6.4302    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.7124    6.8427    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  7  1  0  0  0  0
  6  8  1  0  0  0  0
  1  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  2  0  0  0  0
 12 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  2  0  0  0  0
 16 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
 26 27  1  0  0  0  0
M  END

HMDB0259122
     RDKit          3D
Tresperimus
 64 63  0  0  0  0  0  0  0  0999 V2000
   11.0402    2.1808    1.2465 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.7214    1.7525    1.6122 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3986    0.3781    1.0319 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0011   -0.0554    1.4287 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7623   -1.3591    0.8492 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.4515   -1.8740    1.1600 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3443   -1.0980    0.4962 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4585   -1.1175   -1.0075 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3247   -0.3249   -1.5818 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0318   -0.8273   -1.2388 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.8710   -0.1738   -1.7122 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9801    0.8429   -2.4305 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5908   -0.6278   -1.4028 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5143    0.0807   -1.9134 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7642   -0.6093   -1.4351 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6200   -1.6252   -0.7247 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0351   -0.0696   -1.8157 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2356   -0.7132   -1.3610 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2970   -0.6833    0.1330 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5391   -1.3498    0.6314 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7605   -0.6736    0.1261 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8048    0.7897    0.5575 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.1022    1.3623   -0.0235 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.1768    0.5807    0.5486 N   0  0  0  0  0  0  0  0  0  0  0  0
  -10.3841    0.9920    0.6732 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.3140    0.0968    1.2563 N   0  0  0  0  0  0  0  0  0  0  0  0
  -10.7564    2.2948    0.2390 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.1786    1.9497    0.2219 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.1066    3.2396    1.2731 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.9787    2.4492    1.1568 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.5450    1.7366    2.6948 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.4901    0.5106   -0.0837 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.1571   -0.3643    1.3149 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.2501    0.6431    1.0261 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.9916   -0.1377    2.5252 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.4580   -2.0326    1.2437 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4084   -2.9117    0.7687 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.2653   -1.9341    2.2476 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3138   -0.0379    0.8073 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3837   -1.5568    0.8102 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4039   -0.6136   -1.3044 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5118   -2.1512   -1.4113 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4636   -0.3162   -2.6914 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4097    0.7071   -1.2160 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9439   -1.6634   -0.6485 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5000   -0.0443   -3.0149 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5373    1.1429   -1.6160 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0980    0.7840   -2.4185 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0884   -0.1014   -1.7460 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2929   -1.7530   -1.7588 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2063    0.3724    0.4795 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4428   -1.2857    0.5448 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5311   -2.3936    0.2363 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5331   -1.4002    1.7561 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.6694   -1.1497    0.5810 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8094   -0.6901   -0.9755 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9600    1.3497    0.1480 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8553    0.7819    1.6681 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.0620    1.2152   -1.1088 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.2446    2.4162    0.2910 H   0  0  0  0  0  0  0  0  0  0  0  0
  -12.2544   -0.0631    0.8522 H   0  0  0  0  0  0  0  0  0  0  0  0
  -11.0465   -0.4166    2.1166 H   0  0  0  0  0  0  0  0  0  0  0  0
  -11.0334    2.4151   -0.7467 H   0  0  0  0  0  0  0  0  0  0  0  0
  -10.7670    3.1344    0.8548 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  9 10  1  0
 10 11  1  0
 11 12  2  0
 11 13  1  0
 13 14  1  0
 14 15  1  0
 15 16  2  0
 15 17  1  0
 17 18  1  0
 18 19  1  0
 19 20  1  0
 20 21  1  0
 21 22  1  0
 22 23  1  0
 23 24  1  0
 24 25  2  3
 25 26  1  0
 25 27  1  0
  1 28  1  0
  1 29  1  0
  2 30  1  0
  2 31  1  0
  3 32  1  0
  3 33  1  0
  4 34  1  0
  4 35  1  0
  5 36  1  0
  6 37  1  0
  6 38  1  0
  7 39  1  0
  7 40  1  0
  8 41  1  0
  8 42  1  0
  9 43  1  0
  9 44  1  0
 10 45  1  0
 14 46  1  0
 14 47  1  0
 17 48  1  0
 18 49  1  0
 18 50  1  0
 19 51  1  0
 19 52  1  0
 20 53  1  0
 20 54  1  0
 21 55  1  0
 21 56  1  0
 22 57  1  0
 22 58  1  0
 23 59  1  0
 23 60  1  0
 26 61  1  0
 26 62  1  0
 27 63  1  0
 27 64  1  0
M  END

  Mrv1652309112123352D          

 27 26  0  0  0  0            999 V2000
   12.5664    6.4302    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8520    6.8427    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1375    6.4302    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4230    6.8427    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7086    6.4302    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.9941    6.8427    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2796    6.4302    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.9941    7.6677    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   13.2809    6.8427    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9954    6.4302    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7099    6.8427    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   15.4243    6.4302    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.4243    5.6052    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.1388    6.8427    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.8533    6.4302    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.5677    6.8427    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.5677    7.6677    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.2822    6.4302    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   18.9967    6.8427    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.7112    6.4302    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.4256    6.8427    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.1401    6.4302    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.8546    6.8427    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   22.5690    6.4302    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.2835    6.8427    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.9980    6.4302    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.7124    6.8427    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  7  1  0  0  0  0
  6  8  1  0  0  0  0
  1  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  2  0  0  0  0
 12 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  2  0  0  0  0
 16 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
 26 27  1  0  0  0  0
M  END
> <DATABASE_ID>
HMDB0259122

> <DATABASE_NAME>
hmdb

> <SMILES>
NCCCNCCCCNC(=O)OCC(=O)NCCCCCCN=C(N)N

> <INCHI_IDENTIFIER>
InChI=1S/C17H37N7O3/c18-8-7-10-21-9-5-6-13-24-17(26)27-14-15(25)22-11-3-1-2-4-12-23-16(19)20/h21H,1-14,18H2,(H,22,25)(H,24,26)(H4,19,20,23)

> <INCHI_KEY>
LVBMFPUTQOHXQE-UHFFFAOYSA-N

> <FORMULA>
C17H37N7O3

> <MOLECULAR_WEIGHT>
387.529

> <EXACT_MASS>
387.295788079

> <JCHEM_ACCEPTOR_COUNT>
7

> <JCHEM_ATOM_COUNT>
64

> <JCHEM_AVERAGE_POLARIZABILITY>
45.33187106571259

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
6

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
({6-[(diaminomethylidene)amino]hexyl}carbamoyl)methyl N-{4-[(3-aminopropyl)amino]butyl}carbamate

> <ALOGPS_LOGP>
-0.36

> <JCHEM_LOGP>
-1.5349375933333342

> <ALOGPS_LOGS>
-3.61

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
3

> <JCHEM_PKA>
16.008769745920453

> <JCHEM_PKA_STRONGEST_ACIDIC>
15.26229572228861

> <JCHEM_PKA_STRONGEST_BASIC>
11.73470081111014

> <JCHEM_POLAR_SURFACE_AREA>
169.88000000000002

> <JCHEM_REFRACTIVITY>
105.92289999999997

> <JCHEM_ROTATABLE_BOND_COUNT>
18

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
9.57e-02 g/l

> <JCHEM_TRADITIONAL_IUPAC>
({6-[(diaminomethylidene)amino]hexyl}carbamoyl)methyl N-{4-[(3-aminopropyl)amino]butyl}carbamate

> <JCHEM_VEBER_RULE>
0

$$$$

HMDB0259122
     RDKit          3D
Tresperimus
 64 63  0  0  0  0  0  0  0  0999 V2000
   11.0402    2.1808    1.2465 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.7214    1.7525    1.6122 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3986    0.3781    1.0319 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0011   -0.0554    1.4287 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7623   -1.3591    0.8492 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.4515   -1.8740    1.1600 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3443   -1.0980    0.4962 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4585   -1.1175   -1.0075 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3247   -0.3249   -1.5818 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0318   -0.8273   -1.2388 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.8710   -0.1738   -1.7122 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9801    0.8429   -2.4305 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5908   -0.6278   -1.4028 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5143    0.0807   -1.9134 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7642   -0.6093   -1.4351 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6200   -1.6252   -0.7247 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0351   -0.0696   -1.8157 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2356   -0.7132   -1.3610 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2970   -0.6833    0.1330 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5391   -1.3498    0.6314 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7605   -0.6736    0.1261 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8048    0.7897    0.5575 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.1022    1.3623   -0.0235 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.1768    0.5807    0.5486 N   0  0  0  0  0  0  0  0  0  0  0  0
  -10.3841    0.9920    0.6732 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.3140    0.0968    1.2563 N   0  0  0  0  0  0  0  0  0  0  0  0
  -10.7564    2.2948    0.2390 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.1786    1.9497    0.2219 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.1066    3.2396    1.2731 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.9787    2.4492    1.1568 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.5450    1.7366    2.6948 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.4901    0.5106   -0.0837 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.1571   -0.3643    1.3149 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.2501    0.6431    1.0261 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.9916   -0.1377    2.5252 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.4580   -2.0326    1.2437 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4084   -2.9117    0.7687 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.2653   -1.9341    2.2476 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3138   -0.0379    0.8073 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3837   -1.5568    0.8102 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4039   -0.6136   -1.3044 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5118   -2.1512   -1.4113 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4636   -0.3162   -2.6914 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4097    0.7071   -1.2160 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9439   -1.6634   -0.6485 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5000   -0.0443   -3.0149 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5373    1.1429   -1.6160 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0980    0.7840   -2.4185 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0884   -0.1014   -1.7460 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2929   -1.7530   -1.7588 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2063    0.3724    0.4795 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4428   -1.2857    0.5448 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5311   -2.3936    0.2363 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5331   -1.4002    1.7561 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.6694   -1.1497    0.5810 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8094   -0.6901   -0.9755 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9600    1.3497    0.1480 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8553    0.7819    1.6681 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.0620    1.2152   -1.1088 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.2446    2.4162    0.2910 H   0  0  0  0  0  0  0  0  0  0  0  0
  -12.2544   -0.0631    0.8522 H   0  0  0  0  0  0  0  0  0  0  0  0
  -11.0465   -0.4166    2.1166 H   0  0  0  0  0  0  0  0  0  0  0  0
  -11.0334    2.4151   -0.7467 H   0  0  0  0  0  0  0  0  0  0  0  0
  -10.7670    3.1344    0.8548 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  9 10  1  0
 10 11  1  0
 11 12  2  0
 11 13  1  0
 13 14  1  0
 14 15  1  0
 15 16  2  0
 15 17  1  0
 17 18  1  0
 18 19  1  0
 19 20  1  0
 20 21  1  0
 21 22  1  0
 22 23  1  0
 23 24  1  0
 24 25  2  3
 25 26  1  0
 25 27  1  0
  1 28  1  0
  1 29  1  0
  2 30  1  0
  2 31  1  0
  3 32  1  0
  3 33  1  0
  4 34  1  0
  4 35  1  0
  5 36  1  0
  6 37  1  0
  6 38  1  0
  7 39  1  0
  7 40  1  0
  8 41  1  0
  8 42  1  0
  9 43  1  0
  9 44  1  0
 10 45  1  0
 14 46  1  0
 14 47  1  0
 17 48  1  0
 18 49  1  0
 18 50  1  0
 19 51  1  0
 19 52  1  0
 20 53  1  0
 20 54  1  0
 21 55  1  0
 21 56  1  0
 22 57  1  0
 22 58  1  0
 23 59  1  0
 23 60  1  0
 26 61  1  0
 26 62  1  0
 27 63  1  0
 27 64  1  0
M  END

HEADER    PROTEIN                                 11-SEP-21   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   11-SEP-21         0                                  
HETATM    1  C   UNK     0      23.457  12.003   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0      22.124  12.773   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0      20.790  12.003   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0      19.456  12.773   0.000  0.00  0.00           C+0
HETATM    5  N   UNK     0      18.123  12.003   0.000  0.00  0.00           N+0
HETATM    6  C   UNK     0      16.789  12.773   0.000  0.00  0.00           C+0
HETATM    7  N   UNK     0      15.455  12.003   0.000  0.00  0.00           N+0
HETATM    8  N   UNK     0      16.789  14.313   0.000  0.00  0.00           N+0
HETATM    9  C   UNK     0      24.791  12.773   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0      26.125  12.003   0.000  0.00  0.00           C+0
HETATM   11  N   UNK     0      27.458  12.773   0.000  0.00  0.00           N+0
HETATM   12  C   UNK     0      28.792  12.003   0.000  0.00  0.00           C+0
HETATM   13  O   UNK     0      28.792  10.463   0.000  0.00  0.00           O+0
HETATM   14  C   UNK     0      30.126  12.773   0.000  0.00  0.00           C+0
HETATM   15  O   UNK     0      31.459  12.003   0.000  0.00  0.00           O+0
HETATM   16  C   UNK     0      32.793  12.773   0.000  0.00  0.00           C+0
HETATM   17  O   UNK     0      32.793  14.313   0.000  0.00  0.00           O+0
HETATM   18  N   UNK     0      34.127  12.003   0.000  0.00  0.00           N+0
HETATM   19  C   UNK     0      35.460  12.773   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0      36.794  12.003   0.000  0.00  0.00           C+0
HETATM   21  C   UNK     0      38.128  12.773   0.000  0.00  0.00           C+0
HETATM   22  C   UNK     0      39.462  12.003   0.000  0.00  0.00           C+0
HETATM   23  N   UNK     0      40.795  12.773   0.000  0.00  0.00           N+0
HETATM   24  C   UNK     0      42.129  12.003   0.000  0.00  0.00           C+0
HETATM   25  C   UNK     0      43.463  12.773   0.000  0.00  0.00           C+0
HETATM   26  C   UNK     0      44.796  12.003   0.000  0.00  0.00           C+0
HETATM   27  N   UNK     0      46.130  12.773   0.000  0.00  0.00           N+0
CONECT    1    2    9                                                       
CONECT    2    1    3                                                       
CONECT    3    2    4                                                       
CONECT    4    3    5                                                       
CONECT    5    4    6                                                       
CONECT    6    5    7    8                                                  
CONECT    7    6                                                            
CONECT    8    6                                                            
CONECT    9    1   10                                                       
CONECT   10    9   11                                                       
CONECT   11   10   12                                                       
CONECT   12   11   13   14                                                  
CONECT   13   12                                                            
CONECT   14   12   15                                                       
CONECT   15   14   16                                                       
CONECT   16   15   17   18                                                  
CONECT   17   16                                                            
CONECT   18   16   19                                                       
CONECT   19   18   20                                                       
CONECT   20   19   21                                                       
CONECT   21   20   22                                                       
CONECT   22   21   23                                                       
CONECT   23   22   24                                                       
CONECT   24   23   25                                                       
CONECT   25   24   26                                                       
CONECT   26   25   27                                                       
CONECT   27   26                                                            
MASTER        0    0    0    0    0    0    0    0   27    0   52    0
END

COMPND    HMDB0259122
HETATM    1  N1  UNL     1      11.040   2.181   1.246  1.00  0.00           N  
HETATM    2  C1  UNL     1       9.721   1.753   1.612  1.00  0.00           C  
HETATM    3  C2  UNL     1       9.399   0.378   1.032  1.00  0.00           C  
HETATM    4  C3  UNL     1       8.001  -0.055   1.429  1.00  0.00           C  
HETATM    5  N2  UNL     1       7.762  -1.359   0.849  1.00  0.00           N  
HETATM    6  C4  UNL     1       6.451  -1.874   1.160  1.00  0.00           C  
HETATM    7  C5  UNL     1       5.344  -1.098   0.496  1.00  0.00           C  
HETATM    8  C6  UNL     1       5.459  -1.118  -1.008  1.00  0.00           C  
HETATM    9  C7  UNL     1       4.325  -0.325  -1.582  1.00  0.00           C  
HETATM   10  N3  UNL     1       3.032  -0.827  -1.239  1.00  0.00           N  
HETATM   11  C8  UNL     1       1.871  -0.174  -1.712  1.00  0.00           C  
HETATM   12  O1  UNL     1       1.980   0.843  -2.431  1.00  0.00           O  
HETATM   13  O2  UNL     1       0.591  -0.628  -1.403  1.00  0.00           O  
HETATM   14  C9  UNL     1      -0.514   0.081  -1.913  1.00  0.00           C  
HETATM   15  C10 UNL     1      -1.764  -0.609  -1.435  1.00  0.00           C  
HETATM   16  O3  UNL     1      -1.620  -1.625  -0.725  1.00  0.00           O  
HETATM   17  N4  UNL     1      -3.035  -0.070  -1.816  1.00  0.00           N  
HETATM   18  C11 UNL     1      -4.236  -0.713  -1.361  1.00  0.00           C  
HETATM   19  C12 UNL     1      -4.297  -0.683   0.133  1.00  0.00           C  
HETATM   20  C13 UNL     1      -5.539  -1.350   0.631  1.00  0.00           C  
HETATM   21  C14 UNL     1      -6.761  -0.674   0.126  1.00  0.00           C  
HETATM   22  C15 UNL     1      -6.805   0.790   0.557  1.00  0.00           C  
HETATM   23  C16 UNL     1      -8.102   1.362  -0.024  1.00  0.00           C  
HETATM   24  N5  UNL     1      -9.177   0.581   0.549  1.00  0.00           N  
HETATM   25  C17 UNL     1     -10.384   0.992   0.673  1.00  0.00           C  
HETATM   26  N6  UNL     1     -11.314   0.097   1.256  1.00  0.00           N  
HETATM   27  N7  UNL     1     -10.756   2.295   0.239  1.00  0.00           N  
HETATM   28  H1  UNL     1      11.179   1.950   0.222  1.00  0.00           H  
HETATM   29  H2  UNL     1      11.107   3.240   1.273  1.00  0.00           H  
HETATM   30  H3  UNL     1       8.979   2.449   1.157  1.00  0.00           H  
HETATM   31  H4  UNL     1       9.545   1.737   2.695  1.00  0.00           H  
HETATM   32  H5  UNL     1       9.490   0.511  -0.084  1.00  0.00           H  
HETATM   33  H6  UNL     1      10.157  -0.364   1.315  1.00  0.00           H  
HETATM   34  H7  UNL     1       7.250   0.643   1.026  1.00  0.00           H  
HETATM   35  H8  UNL     1       7.992  -0.138   2.525  1.00  0.00           H  
HETATM   36  H9  UNL     1       8.458  -2.033   1.244  1.00  0.00           H  
HETATM   37  H10 UNL     1       6.408  -2.912   0.769  1.00  0.00           H  
HETATM   38  H11 UNL     1       6.265  -1.934   2.248  1.00  0.00           H  
HETATM   39  H12 UNL     1       5.314  -0.038   0.807  1.00  0.00           H  
HETATM   40  H13 UNL     1       4.384  -1.557   0.810  1.00  0.00           H  
HETATM   41  H14 UNL     1       6.404  -0.614  -1.304  1.00  0.00           H  
HETATM   42  H15 UNL     1       5.512  -2.151  -1.411  1.00  0.00           H  
HETATM   43  H16 UNL     1       4.464  -0.316  -2.691  1.00  0.00           H  
HETATM   44  H17 UNL     1       4.410   0.707  -1.216  1.00  0.00           H  
HETATM   45  H18 UNL     1       2.944  -1.663  -0.648  1.00  0.00           H  
HETATM   46  H19 UNL     1      -0.500  -0.044  -3.015  1.00  0.00           H  
HETATM   47  H20 UNL     1      -0.537   1.143  -1.616  1.00  0.00           H  
HETATM   48  H21 UNL     1      -3.098   0.784  -2.419  1.00  0.00           H  
HETATM   49  H22 UNL     1      -5.088  -0.101  -1.746  1.00  0.00           H  
HETATM   50  H23 UNL     1      -4.293  -1.753  -1.759  1.00  0.00           H  
HETATM   51  H24 UNL     1      -4.206   0.372   0.480  1.00  0.00           H  
HETATM   52  H25 UNL     1      -3.443  -1.286   0.545  1.00  0.00           H  
HETATM   53  H26 UNL     1      -5.531  -2.394   0.236  1.00  0.00           H  
HETATM   54  H27 UNL     1      -5.533  -1.400   1.756  1.00  0.00           H  
HETATM   55  H28 UNL     1      -7.669  -1.150   0.581  1.00  0.00           H  
HETATM   56  H29 UNL     1      -6.809  -0.690  -0.975  1.00  0.00           H  
HETATM   57  H30 UNL     1      -5.960   1.350   0.148  1.00  0.00           H  
HETATM   58  H31 UNL     1      -6.855   0.782   1.668  1.00  0.00           H  
HETATM   59  H32 UNL     1      -8.062   1.215  -1.109  1.00  0.00           H  
HETATM   60  H33 UNL     1      -8.245   2.416   0.291  1.00  0.00           H  
HETATM   61  H34 UNL     1     -12.254  -0.063   0.852  1.00  0.00           H  
HETATM   62  H35 UNL     1     -11.046  -0.417   2.117  1.00  0.00           H  
HETATM   63  H36 UNL     1     -11.033   2.415  -0.747  1.00  0.00           H  
HETATM   64  H37 UNL     1     -10.767   3.134   0.855  1.00  0.00           H  
CONECT    1    2   28   29
CONECT    2    3   30   31
CONECT    3    4   32   33
CONECT    4    5   34   35
CONECT    5    6   36
CONECT    6    7   37   38
CONECT    7    8   39   40
CONECT    8    9   41   42
CONECT    9   10   43   44
CONECT   10   11   45
CONECT   11   12   12   13
CONECT   13   14
CONECT   14   15   46   47
CONECT   15   16   16   17
CONECT   17   18   48
CONECT   18   19   49   50
CONECT   19   20   51   52
CONECT   20   21   53   54
CONECT   21   22   55   56
CONECT   22   23   57   58
CONECT   23   24   59   60
CONECT   24   25   25
CONECT   25   26   27
CONECT   26   61   62
CONECT   27   63   64
END

HMDB0259122
     RDKit          3D
Tresperimus
 64 63  0  0  0  0  0  0  0  0999 V2000
   11.0402    2.1808    1.2465 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.7214    1.7525    1.6122 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3986    0.3781    1.0319 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0011   -0.0554    1.4287 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7623   -1.3591    0.8492 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.4515   -1.8740    1.1600 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3443   -1.0980    0.4962 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4585   -1.1175   -1.0075 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3247   -0.3249   -1.5818 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0318   -0.8273   -1.2388 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.8710   -0.1738   -1.7122 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9801    0.8429   -2.4305 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5908   -0.6278   -1.4028 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5143    0.0807   -1.9134 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7642   -0.6093   -1.4351 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6200   -1.6252   -0.7247 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0351   -0.0696   -1.8157 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2356   -0.7132   -1.3610 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2970   -0.6833    0.1330 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5391   -1.3498    0.6314 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7605   -0.6736    0.1261 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8048    0.7897    0.5575 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.1022    1.3623   -0.0235 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.1768    0.5807    0.5486 N   0  0  0  0  0  0  0  0  0  0  0  0
  -10.3841    0.9920    0.6732 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.3140    0.0968    1.2563 N   0  0  0  0  0  0  0  0  0  0  0  0
  -10.7564    2.2948    0.2390 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.1786    1.9497    0.2219 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.1066    3.2396    1.2731 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.9787    2.4492    1.1568 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.5450    1.7366    2.6948 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.4901    0.5106   -0.0837 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.1571   -0.3643    1.3149 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.2501    0.6431    1.0261 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.9916   -0.1377    2.5252 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.4580   -2.0326    1.2437 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4084   -2.9117    0.7687 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.2653   -1.9341    2.2476 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3138   -0.0379    0.8073 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3837   -1.5568    0.8102 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4039   -0.6136   -1.3044 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5118   -2.1512   -1.4113 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4636   -0.3162   -2.6914 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4097    0.7071   -1.2160 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9439   -1.6634   -0.6485 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5000   -0.0443   -3.0149 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5373    1.1429   -1.6160 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0980    0.7840   -2.4185 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0884   -0.1014   -1.7460 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2929   -1.7530   -1.7588 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2063    0.3724    0.4795 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4428   -1.2857    0.5448 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5311   -2.3936    0.2363 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5331   -1.4002    1.7561 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.6694   -1.1497    0.5810 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8094   -0.6901   -0.9755 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9600    1.3497    0.1480 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8553    0.7819    1.6681 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.0620    1.2152   -1.1088 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.2446    2.4162    0.2910 H   0  0  0  0  0  0  0  0  0  0  0  0
  -12.2544   -0.0631    0.8522 H   0  0  0  0  0  0  0  0  0  0  0  0
  -11.0465   -0.4166    2.1166 H   0  0  0  0  0  0  0  0  0  0  0  0
  -11.0334    2.4151   -0.7467 H   0  0  0  0  0  0  0  0  0  0  0  0
  -10.7670    3.1344    0.8548 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  9 10  1  0
 10 11  1  0
 11 12  2  0
 11 13  1  0
 13 14  1  0
 14 15  1  0
 15 16  2  0
 15 17  1  0
 17 18  1  0
 18 19  1  0
 19 20  1  0
 20 21  1  0
 21 22  1  0
 22 23  1  0
 23 24  1  0
 24 25  2  3
 25 26  1  0
 25 27  1  0
  1 28  1  0
  1 29  1  0
  2 30  1  0
  2 31  1  0
  3 32  1  0
  3 33  1  0
  4 34  1  0
  4 35  1  0
  5 36  1  0
  6 37  1  0
  6 38  1  0
  7 39  1  0
  7 40  1  0
  8 41  1  0
  8 42  1  0
  9 43  1  0
  9 44  1  0
 10 45  1  0
 14 46  1  0
 14 47  1  0
 17 48  1  0
 18 49  1  0
 18 50  1  0
 19 51  1  0
 19 52  1  0
 20 53  1  0
 20 54  1  0
 21 55  1  0
 21 56  1  0
 22 57  1  0
 22 58  1  0
 23 59  1  0
 23 60  1  0
 26 61  1  0
 26 62  1  0
 27 63  1  0
 27 64  1  0
M  END

View in JSmol View Stereo Labels

Synonyms

Value	Source
2-[({4-[(3-aminopropyl)amino]butyl}-C-hydroxycarbonimidoyl)oxy]-N-(6-carbamimidamidohexyl)ethanimidate	HMDB
(4-((3-Aminopropyl)amino)butyl)-2-((6-((aminoiminomethyl)amino)hexyl)amino)-2-oxoethyl carbamic acid ester, trihydrochloride	HMDB

Chemical Formula

C₁₇H₃₇N₇O₃

Average Molecular Weight

387.529

Monoisotopic Molecular Weight

387.295788079

IUPAC Name

({6-[(diaminomethylidene)amino]hexyl}carbamoyl)methyl N-{4-[(3-aminopropyl)amino]butyl}carbamate

Traditional Name

({6-[(diaminomethylidene)amino]hexyl}carbamoyl)methyl N-{4-[(3-aminopropyl)amino]butyl}carbamate

CAS Registry Number

Not Available

SMILES

NCCCNCCCCNC(=O)OCC(=O)NCCCCCCN=C(N)N

InChI Identifier

InChI=1S/C17H37N7O3/c18-8-7-10-21-9-5-6-13-24-17(26)27-14-15(25)22-11-3-1-2-4-12-23-16(19)20/h21H,1-14,18H2,(H,22,25)(H,24,26)(H4,19,20,23)

InChI Key

LVBMFPUTQOHXQE-UHFFFAOYSA-N

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as carbamate esters. Carbamate esters are compounds containing an ester of carbamic acid with the general structure R2NC(=O)OR' (R' not H). They are esters of carbamic acids.

Kingdom

Organic compounds

Super Class

Organic acids and derivatives

Class

Carboxylic acids and derivatives

Sub Class

Amino acids, peptides, and analogues

Direct Parent

Carbamate esters

Alternative Parents

Substituents

Carbamic acid ester
Carboxamide group
Guanidine
Secondary carboxylic acid amide
Secondary aliphatic amine
Secondary amine
Carboximidamide
Propargyl-type 1,3-dipolar organic compound
Organic 1,3-dipolar compound
Amine
Primary amine
Organooxygen compound
Organonitrogen compound
Primary aliphatic amine
Organic oxygen compound
Organic oxide
Hydrocarbon derivative
Carbonyl group
Organic nitrogen compound
Aliphatic acyclic compound

Molecular Framework

Aliphatic acyclic compounds

External Descriptors

Not Available

Ontology

Physiological effect

Not Available

Disposition

Biological location

Non-excretory biofluid

Biofluid or Excreta

Blood (PMID: 31557052)

Source

Exogenous

Exogenous (PMID: 31557052)

Process

Not Available

Role

Not Available

Physical Properties

State

Not Available

Experimental Molecular Properties

Property	Value	Reference
Melting Point	Not Available	Not Available
Boiling Point	Not Available	Not Available
Water Solubility	Not Available	Not Available
LogP	Not Available	Not Available

Experimental Chromatographic Properties

Not Available

Predicted Molecular Properties

Property	Value	Source
logP	-0.36	ALOGPS
logP	-1.5	ChemAxon
logS	-3.6	ALOGPS
pKa (Strongest Acidic)	15.26	ChemAxon
pKa (Strongest Basic)	11.73	ChemAxon
Physiological Charge	3	ChemAxon
Hydrogen Acceptor Count	7	ChemAxon
Hydrogen Donor Count	6	ChemAxon
Polar Surface Area	169.88 Å²	ChemAxon
Rotatable Bond Count	18	ChemAxon
Refractivity	105.92 m³·mol⁻¹	ChemAxon
Polarizability	45.33 Å³	ChemAxon
Number of Rings	0	ChemAxon
Bioavailability	No	ChemAxon
Rule of Five	No	ChemAxon
Ghose Filter	No	ChemAxon
Veber's Rule	No	ChemAxon
MDDR-like Rule	No	ChemAxon

Predicted Chromatographic Properties

Predicted Collision Cross Sections

Predictor	Adduct Type	CCS Value (Å²)	Reference
DeepCCS	[M+H]+	193.129	30932474
DeepCCS	[M-H]-	190.771	30932474
DeepCCS	[M-2H]-	223.656	30932474
DeepCCS	[M+Na]+	199.222	30932474
AllCCS	[M+H]+	188.4	32859911
AllCCS	[M+H-H2O]+	186.5	32859911
AllCCS	[M+NH4]+	190.2	32859911
AllCCS	[M+Na]+	190.7	32859911
AllCCS	[M-H]-	198.6	32859911
AllCCS	[M+Na-2H]-	199.6	32859911
AllCCS	[M+HCOO]-	200.9	32859911

Predicted Kovats Retention Indices

Underivatized

Metabolite	SMILES	Kovats RI Value	Column Type	Reference
Tresperimus	NCCCNCCCCNC(=O)OCC(=O)NCCCCCCN=C(N)N	4093.1	Standard polar	33892256
Tresperimus	NCCCNCCCCNC(=O)OCC(=O)NCCCCCCN=C(N)N	3460.7	Standard non polar	33892256
Tresperimus	NCCCNCCCCNC(=O)OCC(=O)NCCCCCCN=C(N)N	3777.3	Semi standard non polar	33892256

Derivatized

Derivative Name / Structure	SMILES	Kovats RI Value	Column Type	Reference
Tresperimus,1TMS,isomer #1	C[Si](C)(C)NCCCNCCCCNC(=O)OCC(=O)NCCCCCCN=C(N)N	3836.8	Semi standard non polar	33892256
Tresperimus,1TMS,isomer #1	C[Si](C)(C)NCCCNCCCCNC(=O)OCC(=O)NCCCCCCN=C(N)N	3554.5	Standard non polar	33892256
Tresperimus,1TMS,isomer #1	C[Si](C)(C)NCCCNCCCCNC(=O)OCC(=O)NCCCCCCN=C(N)N	6751.2	Standard polar	33892256
Tresperimus,1TMS,isomer #2	C[Si](C)(C)NC(N)=NCCCCCCNC(=O)COC(=O)NCCCCNCCCN	3853.2	Semi standard non polar	33892256
Tresperimus,1TMS,isomer #2	C[Si](C)(C)NC(N)=NCCCCCCNC(=O)COC(=O)NCCCCNCCCN	3477.6	Standard non polar	33892256
Tresperimus,1TMS,isomer #2	C[Si](C)(C)NC(N)=NCCCCCCNC(=O)COC(=O)NCCCCNCCCN	6925.1	Standard polar	33892256
Tresperimus,1TMS,isomer #3	C[Si](C)(C)N(CCCN)CCCCNC(=O)OCC(=O)NCCCCCCN=C(N)N	3732.5	Semi standard non polar	33892256
Tresperimus,1TMS,isomer #3	C[Si](C)(C)N(CCCN)CCCCNC(=O)OCC(=O)NCCCCCCN=C(N)N	3371.2	Standard non polar	33892256
Tresperimus,1TMS,isomer #3	C[Si](C)(C)N(CCCN)CCCCNC(=O)OCC(=O)NCCCCCCN=C(N)N	7020.2	Standard polar	33892256
Tresperimus,1TMS,isomer #4	C[Si](C)(C)N(CCCCNCCCN)C(=O)OCC(=O)NCCCCCCN=C(N)N	3679.5	Semi standard non polar	33892256
Tresperimus,1TMS,isomer #4	C[Si](C)(C)N(CCCCNCCCN)C(=O)OCC(=O)NCCCCCCN=C(N)N	3336.9	Standard non polar	33892256
Tresperimus,1TMS,isomer #4	C[Si](C)(C)N(CCCCNCCCN)C(=O)OCC(=O)NCCCCCCN=C(N)N	6990.5	Standard polar	33892256
Tresperimus,1TMS,isomer #5	C[Si](C)(C)N(CCCCCCN=C(N)N)C(=O)COC(=O)NCCCCNCCCN	3680.9	Semi standard non polar	33892256
Tresperimus,1TMS,isomer #5	C[Si](C)(C)N(CCCCCCN=C(N)N)C(=O)COC(=O)NCCCCNCCCN	3367.5	Standard non polar	33892256
Tresperimus,1TMS,isomer #5	C[Si](C)(C)N(CCCCCCN=C(N)N)C(=O)COC(=O)NCCCCNCCCN	7008.4	Standard polar	33892256
Tresperimus,2TMS,isomer #1	C[Si](C)(C)NCCCNCCCCNC(=O)OCC(=O)NCCCCCCN=C(N)N[Si](C)(C)C	3910.1	Semi standard non polar	33892256
Tresperimus,2TMS,isomer #1	C[Si](C)(C)NCCCNCCCCNC(=O)OCC(=O)NCCCCCCN=C(N)N[Si](C)(C)C	3619.5	Standard non polar	33892256
Tresperimus,2TMS,isomer #1	C[Si](C)(C)NCCCNCCCCNC(=O)OCC(=O)NCCCCCCN=C(N)N[Si](C)(C)C	6483.9	Standard polar	33892256
Tresperimus,2TMS,isomer #10	C[Si](C)(C)NC(N)=NCCCCCCNC(=O)COC(=O)NCCCCN(CCCN)[Si](C)(C)C	3824.2	Semi standard non polar	33892256
Tresperimus,2TMS,isomer #10	C[Si](C)(C)NC(N)=NCCCCCCNC(=O)COC(=O)NCCCCN(CCCN)[Si](C)(C)C	3442.3	Standard non polar	33892256
Tresperimus,2TMS,isomer #10	C[Si](C)(C)NC(N)=NCCCCCCNC(=O)COC(=O)NCCCCN(CCCN)[Si](C)(C)C	6763.6	Standard polar	33892256
Tresperimus,2TMS,isomer #11	C[Si](C)(C)N(CCCN)CCCCN(C(=O)OCC(=O)NCCCCCCN=C(N)N)[Si](C)(C)C	3623.8	Semi standard non polar	33892256
Tresperimus,2TMS,isomer #11	C[Si](C)(C)N(CCCN)CCCCN(C(=O)OCC(=O)NCCCCCCN=C(N)N)[Si](C)(C)C	3350.3	Standard non polar	33892256
Tresperimus,2TMS,isomer #11	C[Si](C)(C)N(CCCN)CCCCN(C(=O)OCC(=O)NCCCCCCN=C(N)N)[Si](C)(C)C	6863.6	Standard polar	33892256
Tresperimus,2TMS,isomer #12	C[Si](C)(C)N(CCCN)CCCCNC(=O)OCC(=O)N(CCCCCCN=C(N)N)[Si](C)(C)C	3628.4	Semi standard non polar	33892256
Tresperimus,2TMS,isomer #12	C[Si](C)(C)N(CCCN)CCCCNC(=O)OCC(=O)N(CCCCCCN=C(N)N)[Si](C)(C)C	3387.1	Standard non polar	33892256
Tresperimus,2TMS,isomer #12	C[Si](C)(C)N(CCCN)CCCCNC(=O)OCC(=O)N(CCCCCCN=C(N)N)[Si](C)(C)C	6883.6	Standard polar	33892256
Tresperimus,2TMS,isomer #13	C[Si](C)(C)N(CCCCCCN=C(N)N)C(=O)COC(=O)N(CCCCNCCCN)[Si](C)(C)C	3549.2	Semi standard non polar	33892256
Tresperimus,2TMS,isomer #13	C[Si](C)(C)N(CCCCCCN=C(N)N)C(=O)COC(=O)N(CCCCNCCCN)[Si](C)(C)C	3358.0	Standard non polar	33892256
Tresperimus,2TMS,isomer #13	C[Si](C)(C)N(CCCCCCN=C(N)N)C(=O)COC(=O)N(CCCCNCCCN)[Si](C)(C)C	6844.4	Standard polar	33892256
Tresperimus,2TMS,isomer #2	C[Si](C)(C)N(CCCNCCCCNC(=O)OCC(=O)NCCCCCCN=C(N)N)[Si](C)(C)C	3916.1	Semi standard non polar	33892256
Tresperimus,2TMS,isomer #2	C[Si](C)(C)N(CCCNCCCCNC(=O)OCC(=O)NCCCCCCN=C(N)N)[Si](C)(C)C	3563.0	Standard non polar	33892256
Tresperimus,2TMS,isomer #2	C[Si](C)(C)N(CCCNCCCCNC(=O)OCC(=O)NCCCCCCN=C(N)N)[Si](C)(C)C	6665.1	Standard polar	33892256
Tresperimus,2TMS,isomer #3	C[Si](C)(C)NCCCN(CCCCNC(=O)OCC(=O)NCCCCCCN=C(N)N)[Si](C)(C)C	3812.3	Semi standard non polar	33892256
Tresperimus,2TMS,isomer #3	C[Si](C)(C)NCCCN(CCCCNC(=O)OCC(=O)NCCCCCCN=C(N)N)[Si](C)(C)C	3509.7	Standard non polar	33892256
Tresperimus,2TMS,isomer #3	C[Si](C)(C)NCCCN(CCCCNC(=O)OCC(=O)NCCCCCCN=C(N)N)[Si](C)(C)C	6629.6	Standard polar	33892256
Tresperimus,2TMS,isomer #4	C[Si](C)(C)NCCCNCCCCN(C(=O)OCC(=O)NCCCCCCN=C(N)N)[Si](C)(C)C	3739.9	Semi standard non polar	33892256
Tresperimus,2TMS,isomer #4	C[Si](C)(C)NCCCNCCCCN(C(=O)OCC(=O)NCCCCCCN=C(N)N)[Si](C)(C)C	3475.4	Standard non polar	33892256
Tresperimus,2TMS,isomer #4	C[Si](C)(C)NCCCNCCCCN(C(=O)OCC(=O)NCCCCCCN=C(N)N)[Si](C)(C)C	6576.4	Standard polar	33892256
Tresperimus,2TMS,isomer #5	C[Si](C)(C)NCCCNCCCCNC(=O)OCC(=O)N(CCCCCCN=C(N)N)[Si](C)(C)C	3739.1	Semi standard non polar	33892256
Tresperimus,2TMS,isomer #5	C[Si](C)(C)NCCCNCCCCNC(=O)OCC(=O)N(CCCCCCN=C(N)N)[Si](C)(C)C	3512.2	Standard non polar	33892256
Tresperimus,2TMS,isomer #5	C[Si](C)(C)NCCCNCCCCNC(=O)OCC(=O)N(CCCCCCN=C(N)N)[Si](C)(C)C	6595.7	Standard polar	33892256
Tresperimus,2TMS,isomer #6	C[Si](C)(C)NC(=NCCCCCCNC(=O)COC(=O)NCCCCNCCCN)N[Si](C)(C)C	3959.7	Semi standard non polar	33892256
Tresperimus,2TMS,isomer #6	C[Si](C)(C)NC(=NCCCCCCNC(=O)COC(=O)NCCCCNCCCN)N[Si](C)(C)C	3421.4	Standard non polar	33892256
Tresperimus,2TMS,isomer #6	C[Si](C)(C)NC(=NCCCCCCNC(=O)COC(=O)NCCCCNCCCN)N[Si](C)(C)C	6512.7	Standard polar	33892256
Tresperimus,2TMS,isomer #7	C[Si](C)(C)N(C(N)=NCCCCCCNC(=O)COC(=O)NCCCCNCCCN)[Si](C)(C)C	3847.5	Semi standard non polar	33892256
Tresperimus,2TMS,isomer #7	C[Si](C)(C)N(C(N)=NCCCCCCNC(=O)COC(=O)NCCCCNCCCN)[Si](C)(C)C	3531.8	Standard non polar	33892256
Tresperimus,2TMS,isomer #7	C[Si](C)(C)N(C(N)=NCCCCCCNC(=O)COC(=O)NCCCCNCCCN)[Si](C)(C)C	6667.6	Standard polar	33892256
Tresperimus,2TMS,isomer #8	C[Si](C)(C)NC(N)=NCCCCCCN(C(=O)COC(=O)NCCCCNCCCN)[Si](C)(C)C	3790.6	Semi standard non polar	33892256
Tresperimus,2TMS,isomer #8	C[Si](C)(C)NC(N)=NCCCCCCN(C(=O)COC(=O)NCCCCNCCCN)[Si](C)(C)C	3452.2	Standard non polar	33892256
Tresperimus,2TMS,isomer #8	C[Si](C)(C)NC(N)=NCCCCCCN(C(=O)COC(=O)NCCCCNCCCN)[Si](C)(C)C	6740.4	Standard polar	33892256
Tresperimus,2TMS,isomer #9	C[Si](C)(C)NC(N)=NCCCCCCNC(=O)COC(=O)N(CCCCNCCCN)[Si](C)(C)C	3765.5	Semi standard non polar	33892256
Tresperimus,2TMS,isomer #9	C[Si](C)(C)NC(N)=NCCCCCCNC(=O)COC(=O)N(CCCCNCCCN)[Si](C)(C)C	3402.9	Standard non polar	33892256
Tresperimus,2TMS,isomer #9	C[Si](C)(C)NC(N)=NCCCCCCNC(=O)COC(=O)N(CCCCNCCCN)[Si](C)(C)C	6719.5	Standard polar	33892256
Tresperimus,3TMS,isomer #1	C[Si](C)(C)NCCCNCCCCNC(=O)OCC(=O)NCCCCCCN=C(N[Si](C)(C)C)N[Si](C)(C)C	4039.2	Semi standard non polar	33892256
Tresperimus,3TMS,isomer #1	C[Si](C)(C)NCCCNCCCCNC(=O)OCC(=O)NCCCCCCN=C(N[Si](C)(C)C)N[Si](C)(C)C	3527.2	Standard non polar	33892256
Tresperimus,3TMS,isomer #1	C[Si](C)(C)NCCCNCCCCNC(=O)OCC(=O)NCCCCCCN=C(N[Si](C)(C)C)N[Si](C)(C)C	5905.6	Standard polar	33892256
Tresperimus,3TMS,isomer #10	C[Si](C)(C)NCCCN(CCCCN(C(=O)OCC(=O)NCCCCCCN=C(N)N)[Si](C)(C)C)[Si](C)(C)C	3723.0	Semi standard non polar	33892256
Tresperimus,3TMS,isomer #10	C[Si](C)(C)NCCCN(CCCCN(C(=O)OCC(=O)NCCCCCCN=C(N)N)[Si](C)(C)C)[Si](C)(C)C	3451.0	Standard non polar	33892256
Tresperimus,3TMS,isomer #10	C[Si](C)(C)NCCCN(CCCCN(C(=O)OCC(=O)NCCCCCCN=C(N)N)[Si](C)(C)C)[Si](C)(C)C	6424.1	Standard polar	33892256
Tresperimus,3TMS,isomer #11	C[Si](C)(C)NCCCN(CCCCNC(=O)OCC(=O)N(CCCCCCN=C(N)N)[Si](C)(C)C)[Si](C)(C)C	3735.9	Semi standard non polar	33892256
Tresperimus,3TMS,isomer #11	C[Si](C)(C)NCCCN(CCCCNC(=O)OCC(=O)N(CCCCCCN=C(N)N)[Si](C)(C)C)[Si](C)(C)C	3486.2	Standard non polar	33892256
Tresperimus,3TMS,isomer #11	C[Si](C)(C)NCCCN(CCCCNC(=O)OCC(=O)N(CCCCCCN=C(N)N)[Si](C)(C)C)[Si](C)(C)C	6442.8	Standard polar	33892256
Tresperimus,3TMS,isomer #12	C[Si](C)(C)NCCCNCCCCN(C(=O)OCC(=O)N(CCCCCCN=C(N)N)[Si](C)(C)C)[Si](C)(C)C	3636.2	Semi standard non polar	33892256
Tresperimus,3TMS,isomer #12	C[Si](C)(C)NCCCNCCCCN(C(=O)OCC(=O)N(CCCCCCN=C(N)N)[Si](C)(C)C)[Si](C)(C)C	3458.4	Standard non polar	33892256
Tresperimus,3TMS,isomer #12	C[Si](C)(C)NCCCNCCCCN(C(=O)OCC(=O)N(CCCCCCN=C(N)N)[Si](C)(C)C)[Si](C)(C)C	6379.3	Standard polar	33892256
Tresperimus,3TMS,isomer #13	C[Si](C)(C)NC(=NCCCCCCNC(=O)COC(=O)NCCCCNCCCN)N([Si](C)(C)C)[Si](C)(C)C	3929.3	Semi standard non polar	33892256
Tresperimus,3TMS,isomer #13	C[Si](C)(C)NC(=NCCCCCCNC(=O)COC(=O)NCCCCNCCCN)N([Si](C)(C)C)[Si](C)(C)C	3514.2	Standard non polar	33892256
Tresperimus,3TMS,isomer #13	C[Si](C)(C)NC(=NCCCCCCNC(=O)COC(=O)NCCCCNCCCN)N([Si](C)(C)C)[Si](C)(C)C	5955.4	Standard polar	33892256
Tresperimus,3TMS,isomer #14	C[Si](C)(C)NC(=NCCCCCCN(C(=O)COC(=O)NCCCCNCCCN)[Si](C)(C)C)N[Si](C)(C)C	3895.7	Semi standard non polar	33892256
Tresperimus,3TMS,isomer #14	C[Si](C)(C)NC(=NCCCCCCN(C(=O)COC(=O)NCCCCNCCCN)[Si](C)(C)C)N[Si](C)(C)C	3357.6	Standard non polar	33892256
Tresperimus,3TMS,isomer #14	C[Si](C)(C)NC(=NCCCCCCN(C(=O)COC(=O)NCCCCNCCCN)[Si](C)(C)C)N[Si](C)(C)C	6153.4	Standard polar	33892256
Tresperimus,3TMS,isomer #15	C[Si](C)(C)NC(=NCCCCCCNC(=O)COC(=O)N(CCCCNCCCN)[Si](C)(C)C)N[Si](C)(C)C	3869.0	Semi standard non polar	33892256
Tresperimus,3TMS,isomer #15	C[Si](C)(C)NC(=NCCCCCCNC(=O)COC(=O)N(CCCCNCCCN)[Si](C)(C)C)N[Si](C)(C)C	3294.7	Standard non polar	33892256
Tresperimus,3TMS,isomer #15	C[Si](C)(C)NC(=NCCCCCCNC(=O)COC(=O)N(CCCCNCCCN)[Si](C)(C)C)N[Si](C)(C)C	6133.7	Standard polar	33892256
Tresperimus,3TMS,isomer #16	C[Si](C)(C)NC(=NCCCCCCNC(=O)COC(=O)NCCCCN(CCCN)[Si](C)(C)C)N[Si](C)(C)C	3930.6	Semi standard non polar	33892256
Tresperimus,3TMS,isomer #16	C[Si](C)(C)NC(=NCCCCCCNC(=O)COC(=O)NCCCCN(CCCN)[Si](C)(C)C)N[Si](C)(C)C	3359.1	Standard non polar	33892256
Tresperimus,3TMS,isomer #16	C[Si](C)(C)NC(=NCCCCCCNC(=O)COC(=O)NCCCCN(CCCN)[Si](C)(C)C)N[Si](C)(C)C	6196.3	Standard polar	33892256
Tresperimus,3TMS,isomer #17	C[Si](C)(C)N(CCCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)C(=O)COC(=O)NCCCCNCCCN	3775.2	Semi standard non polar	33892256
Tresperimus,3TMS,isomer #17	C[Si](C)(C)N(CCCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)C(=O)COC(=O)NCCCCNCCCN	3499.6	Standard non polar	33892256
Tresperimus,3TMS,isomer #17	C[Si](C)(C)N(CCCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)C(=O)COC(=O)NCCCCNCCCN	6453.8	Standard polar	33892256
Tresperimus,3TMS,isomer #18	C[Si](C)(C)N(CCCCNCCCN)C(=O)OCC(=O)NCCCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	3745.7	Semi standard non polar	33892256
Tresperimus,3TMS,isomer #18	C[Si](C)(C)N(CCCCNCCCN)C(=O)OCC(=O)NCCCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	3434.5	Standard non polar	33892256
Tresperimus,3TMS,isomer #18	C[Si](C)(C)N(CCCCNCCCN)C(=O)OCC(=O)NCCCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	6436.0	Standard polar	33892256
Tresperimus,3TMS,isomer #19	C[Si](C)(C)N(CCCN)CCCCNC(=O)OCC(=O)NCCCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	3802.4	Semi standard non polar	33892256
Tresperimus,3TMS,isomer #19	C[Si](C)(C)N(CCCN)CCCCNC(=O)OCC(=O)NCCCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	3489.2	Standard non polar	33892256
Tresperimus,3TMS,isomer #19	C[Si](C)(C)N(CCCN)CCCCNC(=O)OCC(=O)NCCCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	6481.1	Standard polar	33892256
Tresperimus,3TMS,isomer #2	C[Si](C)(C)NC(N)=NCCCCCCNC(=O)COC(=O)NCCCCNCCCN([Si](C)(C)C)[Si](C)(C)C	4030.5	Semi standard non polar	33892256
Tresperimus,3TMS,isomer #2	C[Si](C)(C)NC(N)=NCCCCCCNC(=O)COC(=O)NCCCCNCCCN([Si](C)(C)C)[Si](C)(C)C	3605.4	Standard non polar	33892256
Tresperimus,3TMS,isomer #2	C[Si](C)(C)NC(N)=NCCCCCCNC(=O)COC(=O)NCCCCNCCCN([Si](C)(C)C)[Si](C)(C)C	6272.2	Standard polar	33892256
Tresperimus,3TMS,isomer #20	C[Si](C)(C)NC(N)=NCCCCCCN(C(=O)COC(=O)N(CCCCNCCCN)[Si](C)(C)C)[Si](C)(C)C	3677.4	Semi standard non polar	33892256
Tresperimus,3TMS,isomer #20	C[Si](C)(C)NC(N)=NCCCCCCN(C(=O)COC(=O)N(CCCCNCCCN)[Si](C)(C)C)[Si](C)(C)C	3393.2	Standard non polar	33892256
Tresperimus,3TMS,isomer #20	C[Si](C)(C)NC(N)=NCCCCCCN(C(=O)COC(=O)N(CCCCNCCCN)[Si](C)(C)C)[Si](C)(C)C	6503.5	Standard polar	33892256
Tresperimus,3TMS,isomer #21	C[Si](C)(C)NC(N)=NCCCCCCN(C(=O)COC(=O)NCCCCN(CCCN)[Si](C)(C)C)[Si](C)(C)C	3751.9	Semi standard non polar	33892256
Tresperimus,3TMS,isomer #21	C[Si](C)(C)NC(N)=NCCCCCCN(C(=O)COC(=O)NCCCCN(CCCN)[Si](C)(C)C)[Si](C)(C)C	3433.4	Standard non polar	33892256
Tresperimus,3TMS,isomer #21	C[Si](C)(C)NC(N)=NCCCCCCN(C(=O)COC(=O)NCCCCN(CCCN)[Si](C)(C)C)[Si](C)(C)C	6549.7	Standard polar	33892256
Tresperimus,3TMS,isomer #22	C[Si](C)(C)NC(N)=NCCCCCCNC(=O)COC(=O)N(CCCCN(CCCN)[Si](C)(C)C)[Si](C)(C)C	3722.7	Semi standard non polar	33892256
Tresperimus,3TMS,isomer #22	C[Si](C)(C)NC(N)=NCCCCCCNC(=O)COC(=O)N(CCCCN(CCCN)[Si](C)(C)C)[Si](C)(C)C	3383.8	Standard non polar	33892256
Tresperimus,3TMS,isomer #22	C[Si](C)(C)NC(N)=NCCCCCCNC(=O)COC(=O)N(CCCCN(CCCN)[Si](C)(C)C)[Si](C)(C)C	6530.9	Standard polar	33892256
Tresperimus,3TMS,isomer #23	C[Si](C)(C)N(CCCN)CCCCN(C(=O)OCC(=O)N(CCCCCCN=C(N)N)[Si](C)(C)C)[Si](C)(C)C	3538.9	Semi standard non polar	33892256
Tresperimus,3TMS,isomer #23	C[Si](C)(C)N(CCCN)CCCCN(C(=O)OCC(=O)N(CCCCCCN=C(N)N)[Si](C)(C)C)[Si](C)(C)C	3372.8	Standard non polar	33892256
Tresperimus,3TMS,isomer #23	C[Si](C)(C)N(CCCN)CCCCN(C(=O)OCC(=O)N(CCCCCCN=C(N)N)[Si](C)(C)C)[Si](C)(C)C	6697.3	Standard polar	33892256
Tresperimus,3TMS,isomer #3	C[Si](C)(C)NCCCN(CCCCNC(=O)OCC(=O)NCCCCCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C	3929.4	Semi standard non polar	33892256
Tresperimus,3TMS,isomer #3	C[Si](C)(C)NCCCN(CCCCNC(=O)OCC(=O)NCCCCCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C	3541.6	Standard non polar	33892256
Tresperimus,3TMS,isomer #3	C[Si](C)(C)NCCCN(CCCCNC(=O)OCC(=O)NCCCCCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C	6276.7	Standard polar	33892256
Tresperimus,3TMS,isomer #4	C[Si](C)(C)NCCCNCCCCN(C(=O)OCC(=O)NCCCCCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C	3840.2	Semi standard non polar	33892256
Tresperimus,3TMS,isomer #4	C[Si](C)(C)NCCCNCCCCN(C(=O)OCC(=O)NCCCCCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C	3520.7	Standard non polar	33892256
Tresperimus,3TMS,isomer #4	C[Si](C)(C)NCCCNCCCCN(C(=O)OCC(=O)NCCCCCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C	6203.4	Standard polar	33892256
Tresperimus,3TMS,isomer #5	C[Si](C)(C)NCCCNCCCCNC(=O)OCC(=O)N(CCCCCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C	3874.3	Semi standard non polar	33892256
Tresperimus,3TMS,isomer #5	C[Si](C)(C)NCCCNCCCCNC(=O)OCC(=O)N(CCCCCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C	3565.4	Standard non polar	33892256
Tresperimus,3TMS,isomer #5	C[Si](C)(C)NCCCNCCCCNC(=O)OCC(=O)N(CCCCCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C	6220.5	Standard polar	33892256
Tresperimus,3TMS,isomer #6	C[Si](C)(C)NCCCNCCCCNC(=O)OCC(=O)NCCCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	3917.8	Semi standard non polar	33892256
Tresperimus,3TMS,isomer #6	C[Si](C)(C)NCCCNCCCCNC(=O)OCC(=O)NCCCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	3661.5	Standard non polar	33892256
Tresperimus,3TMS,isomer #6	C[Si](C)(C)NCCCNCCCCNC(=O)OCC(=O)NCCCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	6101.0	Standard polar	33892256
Tresperimus,3TMS,isomer #7	C[Si](C)(C)N(CCCCNC(=O)OCC(=O)NCCCCCCN=C(N)N)CCCN([Si](C)(C)C)[Si](C)(C)C	3936.4	Semi standard non polar	33892256
Tresperimus,3TMS,isomer #7	C[Si](C)(C)N(CCCCNC(=O)OCC(=O)NCCCCCCN=C(N)N)CCCN([Si](C)(C)C)[Si](C)(C)C	3549.8	Standard non polar	33892256
Tresperimus,3TMS,isomer #7	C[Si](C)(C)N(CCCCNC(=O)OCC(=O)NCCCCCCN=C(N)N)CCCN([Si](C)(C)C)[Si](C)(C)C	6495.4	Standard polar	33892256
Tresperimus,3TMS,isomer #8	C[Si](C)(C)N(CCCCNCCCN([Si](C)(C)C)[Si](C)(C)C)C(=O)OCC(=O)NCCCCCCN=C(N)N	3801.1	Semi standard non polar	33892256
Tresperimus,3TMS,isomer #8	C[Si](C)(C)N(CCCCNCCCN([Si](C)(C)C)[Si](C)(C)C)C(=O)OCC(=O)NCCCCCCN=C(N)N	3511.6	Standard non polar	33892256
Tresperimus,3TMS,isomer #8	C[Si](C)(C)N(CCCCNCCCN([Si](C)(C)C)[Si](C)(C)C)C(=O)OCC(=O)NCCCCCCN=C(N)N	6438.3	Standard polar	33892256
Tresperimus,3TMS,isomer #9	C[Si](C)(C)N(CCCCCCN=C(N)N)C(=O)COC(=O)NCCCCNCCCN([Si](C)(C)C)[Si](C)(C)C	3825.9	Semi standard non polar	33892256
Tresperimus,3TMS,isomer #9	C[Si](C)(C)N(CCCCCCN=C(N)N)C(=O)COC(=O)NCCCCNCCCN([Si](C)(C)C)[Si](C)(C)C	3540.4	Standard non polar	33892256
Tresperimus,3TMS,isomer #9	C[Si](C)(C)N(CCCCCCN=C(N)N)C(=O)COC(=O)NCCCCNCCCN([Si](C)(C)C)[Si](C)(C)C	6456.1	Standard polar	33892256
Tresperimus,4TMS,isomer #1	C[Si](C)(C)NC(=NCCCCCCNC(=O)COC(=O)NCCCCNCCCN([Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	4140.4	Semi standard non polar	33892256
Tresperimus,4TMS,isomer #1	C[Si](C)(C)NC(=NCCCCCCNC(=O)COC(=O)NCCCCNCCCN([Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	3486.2	Standard non polar	33892256
Tresperimus,4TMS,isomer #1	C[Si](C)(C)NC(=NCCCCCCNC(=O)COC(=O)NCCCCNCCCN([Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	5529.9	Standard polar	33892256
Tresperimus,4TMS,isomer #10	C[Si](C)(C)NCCCN(CCCCN(C(=O)OCC(=O)NCCCCCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3838.1	Semi standard non polar	33892256
Tresperimus,4TMS,isomer #10	C[Si](C)(C)NCCCN(CCCCN(C(=O)OCC(=O)NCCCCCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3451.1	Standard non polar	33892256
Tresperimus,4TMS,isomer #10	C[Si](C)(C)NCCCN(CCCCN(C(=O)OCC(=O)NCCCCCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	6019.5	Standard polar	33892256
Tresperimus,4TMS,isomer #11	C[Si](C)(C)NCCCN(CCCCNC(=O)OCC(=O)N(CCCCCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3869.0	Semi standard non polar	33892256
Tresperimus,4TMS,isomer #11	C[Si](C)(C)NCCCN(CCCCNC(=O)OCC(=O)N(CCCCCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3494.1	Standard non polar	33892256
Tresperimus,4TMS,isomer #11	C[Si](C)(C)NCCCN(CCCCNC(=O)OCC(=O)N(CCCCCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	6038.9	Standard polar	33892256
Tresperimus,4TMS,isomer #12	C[Si](C)(C)NCCCN(CCCCNC(=O)OCC(=O)NCCCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3903.3	Semi standard non polar	33892256
Tresperimus,4TMS,isomer #12	C[Si](C)(C)NCCCN(CCCCNC(=O)OCC(=O)NCCCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3570.5	Standard non polar	33892256
Tresperimus,4TMS,isomer #12	C[Si](C)(C)NCCCN(CCCCNC(=O)OCC(=O)NCCCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	5936.2	Standard polar	33892256
Tresperimus,4TMS,isomer #13	C[Si](C)(C)NCCCNCCCCN(C(=O)OCC(=O)N(CCCCCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3772.4	Semi standard non polar	33892256
Tresperimus,4TMS,isomer #13	C[Si](C)(C)NCCCNCCCCN(C(=O)OCC(=O)N(CCCCCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3476.3	Standard non polar	33892256
Tresperimus,4TMS,isomer #13	C[Si](C)(C)NCCCNCCCCN(C(=O)OCC(=O)N(CCCCCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	5967.3	Standard polar	33892256
Tresperimus,4TMS,isomer #14	C[Si](C)(C)NCCCNCCCCN(C(=O)OCC(=O)NCCCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3823.3	Semi standard non polar	33892256
Tresperimus,4TMS,isomer #14	C[Si](C)(C)NCCCNCCCCN(C(=O)OCC(=O)NCCCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3535.6	Standard non polar	33892256
Tresperimus,4TMS,isomer #14	C[Si](C)(C)NCCCNCCCCN(C(=O)OCC(=O)NCCCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	5865.1	Standard polar	33892256
Tresperimus,4TMS,isomer #15	C[Si](C)(C)NCCCNCCCCNC(=O)OCC(=O)N(CCCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3855.7	Semi standard non polar	33892256
Tresperimus,4TMS,isomer #15	C[Si](C)(C)NCCCNCCCCNC(=O)OCC(=O)N(CCCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3589.4	Standard non polar	33892256
Tresperimus,4TMS,isomer #15	C[Si](C)(C)NCCCNCCCCNC(=O)OCC(=O)N(CCCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	5881.8	Standard polar	33892256
Tresperimus,4TMS,isomer #16	C[Si](C)(C)N(CCCCN(C(=O)OCC(=O)NCCCCCCN=C(N)N)[Si](C)(C)C)CCCN([Si](C)(C)C)[Si](C)(C)C	3859.0	Semi standard non polar	33892256
Tresperimus,4TMS,isomer #16	C[Si](C)(C)N(CCCCN(C(=O)OCC(=O)NCCCCCCN=C(N)N)[Si](C)(C)C)CCCN([Si](C)(C)C)[Si](C)(C)C	3519.5	Standard non polar	33892256
Tresperimus,4TMS,isomer #16	C[Si](C)(C)N(CCCCN(C(=O)OCC(=O)NCCCCCCN=C(N)N)[Si](C)(C)C)CCCN([Si](C)(C)C)[Si](C)(C)C	6283.9	Standard polar	33892256
Tresperimus,4TMS,isomer #17	C[Si](C)(C)N(CCCCNC(=O)OCC(=O)N(CCCCCCN=C(N)N)[Si](C)(C)C)CCCN([Si](C)(C)C)[Si](C)(C)C	3881.0	Semi standard non polar	33892256
Tresperimus,4TMS,isomer #17	C[Si](C)(C)N(CCCCNC(=O)OCC(=O)N(CCCCCCN=C(N)N)[Si](C)(C)C)CCCN([Si](C)(C)C)[Si](C)(C)C	3543.9	Standard non polar	33892256
Tresperimus,4TMS,isomer #17	C[Si](C)(C)N(CCCCNC(=O)OCC(=O)N(CCCCCCN=C(N)N)[Si](C)(C)C)CCCN([Si](C)(C)C)[Si](C)(C)C	6304.3	Standard polar	33892256
Tresperimus,4TMS,isomer #18	C[Si](C)(C)N(CCCCCCN=C(N)N)C(=O)COC(=O)N(CCCCNCCCN([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3743.7	Semi standard non polar	33892256
Tresperimus,4TMS,isomer #18	C[Si](C)(C)N(CCCCCCN=C(N)N)C(=O)COC(=O)N(CCCCNCCCN([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3511.6	Standard non polar	33892256
Tresperimus,4TMS,isomer #18	C[Si](C)(C)N(CCCCCCN=C(N)N)C(=O)COC(=O)N(CCCCNCCCN([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	6244.6	Standard polar	33892256
Tresperimus,4TMS,isomer #19	C[Si](C)(C)NCCCN(CCCCN(C(=O)OCC(=O)N(CCCCCCN=C(N)N)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3646.7	Semi standard non polar	33892256
Tresperimus,4TMS,isomer #19	C[Si](C)(C)NCCCN(CCCCN(C(=O)OCC(=O)N(CCCCCCN=C(N)N)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3456.6	Standard non polar	33892256
Tresperimus,4TMS,isomer #19	C[Si](C)(C)NCCCN(CCCCN(C(=O)OCC(=O)N(CCCCCCN=C(N)N)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	6232.3	Standard polar	33892256
Tresperimus,4TMS,isomer #2	C[Si](C)(C)NCCCN(CCCCNC(=O)OCC(=O)NCCCCCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C	4042.1	Semi standard non polar	33892256
Tresperimus,4TMS,isomer #2	C[Si](C)(C)NCCCN(CCCCNC(=O)OCC(=O)NCCCCCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C	3426.2	Standard non polar	33892256
Tresperimus,4TMS,isomer #2	C[Si](C)(C)NCCCN(CCCCNC(=O)OCC(=O)NCCCCCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C	5579.5	Standard polar	33892256
Tresperimus,4TMS,isomer #20	C[Si](C)(C)N(C(=NCCCCCCNC(=O)COC(=O)NCCCCNCCCN)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3877.5	Semi standard non polar	33892256
Tresperimus,4TMS,isomer #20	C[Si](C)(C)N(C(=NCCCCCCNC(=O)COC(=O)NCCCCNCCCN)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3602.7	Standard non polar	33892256
Tresperimus,4TMS,isomer #20	C[Si](C)(C)N(C(=NCCCCCCNC(=O)COC(=O)NCCCCNCCCN)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	5476.0	Standard polar	33892256
Tresperimus,4TMS,isomer #21	C[Si](C)(C)NC(=NCCCCCCN(C(=O)COC(=O)NCCCCNCCCN)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3844.7	Semi standard non polar	33892256
Tresperimus,4TMS,isomer #21	C[Si](C)(C)NC(=NCCCCCCN(C(=O)COC(=O)NCCCCNCCCN)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3469.6	Standard non polar	33892256
Tresperimus,4TMS,isomer #21	C[Si](C)(C)NC(=NCCCCCCN(C(=O)COC(=O)NCCCCNCCCN)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	5646.3	Standard polar	33892256
Tresperimus,4TMS,isomer #22	C[Si](C)(C)NC(=NCCCCCCNC(=O)COC(=O)N(CCCCNCCCN)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3789.9	Semi standard non polar	33892256
Tresperimus,4TMS,isomer #22	C[Si](C)(C)NC(=NCCCCCCNC(=O)COC(=O)N(CCCCNCCCN)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3413.3	Standard non polar	33892256
Tresperimus,4TMS,isomer #22	C[Si](C)(C)NC(=NCCCCCCNC(=O)COC(=O)N(CCCCNCCCN)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	5626.0	Standard polar	33892256
Tresperimus,4TMS,isomer #23	C[Si](C)(C)NC(=NCCCCCCNC(=O)COC(=O)NCCCCN(CCCN)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3873.1	Semi standard non polar	33892256
Tresperimus,4TMS,isomer #23	C[Si](C)(C)NC(=NCCCCCCNC(=O)COC(=O)NCCCCN(CCCN)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3455.2	Standard non polar	33892256
Tresperimus,4TMS,isomer #23	C[Si](C)(C)NC(=NCCCCCCNC(=O)COC(=O)NCCCCN(CCCN)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	5691.0	Standard polar	33892256
Tresperimus,4TMS,isomer #24	C[Si](C)(C)NC(=NCCCCCCN(C(=O)COC(=O)N(CCCCNCCCN)[Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	3790.6	Semi standard non polar	33892256
Tresperimus,4TMS,isomer #24	C[Si](C)(C)NC(=NCCCCCCN(C(=O)COC(=O)N(CCCCNCCCN)[Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	3261.5	Standard non polar	33892256
Tresperimus,4TMS,isomer #24	C[Si](C)(C)NC(=NCCCCCCN(C(=O)COC(=O)N(CCCCNCCCN)[Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	5815.5	Standard polar	33892256
Tresperimus,4TMS,isomer #25	C[Si](C)(C)NC(=NCCCCCCN(C(=O)COC(=O)NCCCCN(CCCN)[Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	3864.7	Semi standard non polar	33892256
Tresperimus,4TMS,isomer #25	C[Si](C)(C)NC(=NCCCCCCN(C(=O)COC(=O)NCCCCN(CCCN)[Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	3291.6	Standard non polar	33892256
Tresperimus,4TMS,isomer #25	C[Si](C)(C)NC(=NCCCCCCN(C(=O)COC(=O)NCCCCN(CCCN)[Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	5878.5	Standard polar	33892256
Tresperimus,4TMS,isomer #26	C[Si](C)(C)NC(=NCCCCCCNC(=O)COC(=O)N(CCCCN(CCCN)[Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	3830.1	Semi standard non polar	33892256
Tresperimus,4TMS,isomer #26	C[Si](C)(C)NC(=NCCCCCCNC(=O)COC(=O)N(CCCCN(CCCN)[Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	3237.1	Standard non polar	33892256
Tresperimus,4TMS,isomer #26	C[Si](C)(C)NC(=NCCCCCCNC(=O)COC(=O)N(CCCCN(CCCN)[Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	5858.0	Standard polar	33892256
Tresperimus,4TMS,isomer #27	C[Si](C)(C)N(CCCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)C(=O)COC(=O)N(CCCCNCCCN)[Si](C)(C)C	3687.7	Semi standard non polar	33892256
Tresperimus,4TMS,isomer #27	C[Si](C)(C)N(CCCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)C(=O)COC(=O)N(CCCCNCCCN)[Si](C)(C)C	3416.3	Standard non polar	33892256
Tresperimus,4TMS,isomer #27	C[Si](C)(C)N(CCCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)C(=O)COC(=O)N(CCCCNCCCN)[Si](C)(C)C	6253.5	Standard polar	33892256
Tresperimus,4TMS,isomer #28	C[Si](C)(C)N(CCCN)CCCCNC(=O)OCC(=O)N(CCCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3762.1	Semi standard non polar	33892256
Tresperimus,4TMS,isomer #28	C[Si](C)(C)N(CCCN)CCCCNC(=O)OCC(=O)N(CCCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3464.2	Standard non polar	33892256
Tresperimus,4TMS,isomer #28	C[Si](C)(C)N(CCCN)CCCCNC(=O)OCC(=O)N(CCCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	6300.3	Standard polar	33892256
Tresperimus,4TMS,isomer #29	C[Si](C)(C)N(CCCN)CCCCN(C(=O)OCC(=O)NCCCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3739.4	Semi standard non polar	33892256
Tresperimus,4TMS,isomer #29	C[Si](C)(C)N(CCCN)CCCCN(C(=O)OCC(=O)NCCCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3412.3	Standard non polar	33892256
Tresperimus,4TMS,isomer #29	C[Si](C)(C)N(CCCN)CCCCN(C(=O)OCC(=O)NCCCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	6282.7	Standard polar	33892256
Tresperimus,4TMS,isomer #3	C[Si](C)(C)NCCCNCCCCN(C(=O)OCC(=O)NCCCCCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C	3954.6	Semi standard non polar	33892256
Tresperimus,4TMS,isomer #3	C[Si](C)(C)NCCCNCCCCN(C(=O)OCC(=O)NCCCCCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C	3397.3	Standard non polar	33892256
Tresperimus,4TMS,isomer #3	C[Si](C)(C)NCCCNCCCCN(C(=O)OCC(=O)NCCCCCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C	5484.8	Standard polar	33892256
Tresperimus,4TMS,isomer #30	C[Si](C)(C)NC(N)=NCCCCCCN(C(=O)COC(=O)N(CCCCN(CCCN)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3665.1	Semi standard non polar	33892256
Tresperimus,4TMS,isomer #30	C[Si](C)(C)NC(N)=NCCCCCCN(C(=O)COC(=O)N(CCCCN(CCCN)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3366.5	Standard non polar	33892256
Tresperimus,4TMS,isomer #30	C[Si](C)(C)NC(N)=NCCCCCCN(C(=O)COC(=O)N(CCCCN(CCCN)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	6338.4	Standard polar	33892256
Tresperimus,4TMS,isomer #4	C[Si](C)(C)NCCCNCCCCNC(=O)OCC(=O)N(CCCCCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C	3994.0	Semi standard non polar	33892256
Tresperimus,4TMS,isomer #4	C[Si](C)(C)NCCCNCCCCNC(=O)OCC(=O)N(CCCCCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C	3445.6	Standard non polar	33892256
Tresperimus,4TMS,isomer #4	C[Si](C)(C)NCCCNCCCCNC(=O)OCC(=O)N(CCCCCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C	5497.0	Standard polar	33892256
Tresperimus,4TMS,isomer #5	C[Si](C)(C)NCCCNCCCCNC(=O)OCC(=O)NCCCCCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3999.1	Semi standard non polar	33892256
Tresperimus,4TMS,isomer #5	C[Si](C)(C)NCCCNCCCCNC(=O)OCC(=O)NCCCCCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3635.4	Standard non polar	33892256
Tresperimus,4TMS,isomer #5	C[Si](C)(C)NCCCNCCCCNC(=O)OCC(=O)NCCCCCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	5184.7	Standard polar	33892256
Tresperimus,4TMS,isomer #6	C[Si](C)(C)N(CCCNCCCCNC(=O)OCC(=O)NCCCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4025.9	Semi standard non polar	33892256
Tresperimus,4TMS,isomer #6	C[Si](C)(C)N(CCCNCCCCNC(=O)OCC(=O)NCCCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3636.2	Standard non polar	33892256
Tresperimus,4TMS,isomer #6	C[Si](C)(C)N(CCCNCCCCNC(=O)OCC(=O)NCCCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	5933.7	Standard polar	33892256
Tresperimus,4TMS,isomer #7	C[Si](C)(C)NC(N)=NCCCCCCN(C(=O)COC(=O)NCCCCNCCCN([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3963.8	Semi standard non polar	33892256
Tresperimus,4TMS,isomer #7	C[Si](C)(C)NC(N)=NCCCCCCN(C(=O)COC(=O)NCCCCNCCCN([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3559.1	Standard non polar	33892256
Tresperimus,4TMS,isomer #7	C[Si](C)(C)NC(N)=NCCCCCCN(C(=O)COC(=O)NCCCCNCCCN([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	6037.1	Standard polar	33892256
Tresperimus,4TMS,isomer #8	C[Si](C)(C)NC(N)=NCCCCCCNC(=O)COC(=O)N(CCCCNCCCN([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3916.9	Semi standard non polar	33892256
Tresperimus,4TMS,isomer #8	C[Si](C)(C)NC(N)=NCCCCCCNC(=O)COC(=O)N(CCCCNCCCN([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3516.9	Standard non polar	33892256
Tresperimus,4TMS,isomer #8	C[Si](C)(C)NC(N)=NCCCCCCNC(=O)COC(=O)N(CCCCNCCCN([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	6018.9	Standard polar	33892256
Tresperimus,4TMS,isomer #9	C[Si](C)(C)NC(N)=NCCCCCCNC(=O)COC(=O)NCCCCN(CCCN([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4057.7	Semi standard non polar	33892256
Tresperimus,4TMS,isomer #9	C[Si](C)(C)NC(N)=NCCCCCCNC(=O)COC(=O)NCCCCN(CCCN([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3553.8	Standard non polar	33892256
Tresperimus,4TMS,isomer #9	C[Si](C)(C)NC(N)=NCCCCCCNC(=O)COC(=O)NCCCCN(CCCN([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	6087.0	Standard polar	33892256
Tresperimus,5TMS,isomer #1	C[Si](C)(C)NC(=NCCCCCCNC(=O)COC(=O)NCCCCNCCCN([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	4098.8	Semi standard non polar	33892256
Tresperimus,5TMS,isomer #1	C[Si](C)(C)NC(=NCCCCCCNC(=O)COC(=O)NCCCCNCCCN([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3602.9	Standard non polar	33892256
Tresperimus,5TMS,isomer #1	C[Si](C)(C)NC(=NCCCCCCNC(=O)COC(=O)NCCCCNCCCN([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	4875.5	Standard polar	33892256
Tresperimus,5TMS,isomer #10	C[Si](C)(C)NCCCNCCCCNC(=O)OCC(=O)N(CCCCCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3930.5	Semi standard non polar	33892256
Tresperimus,5TMS,isomer #10	C[Si](C)(C)NCCCNCCCCNC(=O)OCC(=O)N(CCCCCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3565.1	Standard non polar	33892256
Tresperimus,5TMS,isomer #10	C[Si](C)(C)NCCCNCCCCNC(=O)OCC(=O)N(CCCCCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4826.5	Standard polar	33892256
Tresperimus,5TMS,isomer #11	C[Si](C)(C)NCCCNCCCCNC(=O)OCC(=O)NCCCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3953.6	Semi standard non polar	33892256
Tresperimus,5TMS,isomer #11	C[Si](C)(C)NCCCNCCCCNC(=O)OCC(=O)NCCCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3723.0	Standard non polar	33892256
Tresperimus,5TMS,isomer #11	C[Si](C)(C)NCCCNCCCCNC(=O)OCC(=O)NCCCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	4525.5	Standard polar	33892256
Tresperimus,5TMS,isomer #12	C[Si](C)(C)N(CCCCNC(=O)OCC(=O)NCCCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)CCCN([Si](C)(C)C)[Si](C)(C)C	4088.6	Semi standard non polar	33892256
Tresperimus,5TMS,isomer #12	C[Si](C)(C)N(CCCCNC(=O)OCC(=O)NCCCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)CCCN([Si](C)(C)C)[Si](C)(C)C	3584.7	Standard non polar	33892256
Tresperimus,5TMS,isomer #12	C[Si](C)(C)N(CCCCNC(=O)OCC(=O)NCCCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)CCCN([Si](C)(C)C)[Si](C)(C)C	5786.0	Standard polar	33892256
Tresperimus,5TMS,isomer #13	C[Si](C)(C)N(CCCCNCCCN([Si](C)(C)C)[Si](C)(C)C)C(=O)OCC(=O)NCCCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	3959.0	Semi standard non polar	33892256
Tresperimus,5TMS,isomer #13	C[Si](C)(C)N(CCCCNCCCN([Si](C)(C)C)[Si](C)(C)C)C(=O)OCC(=O)NCCCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	3543.1	Standard non polar	33892256
Tresperimus,5TMS,isomer #13	C[Si](C)(C)N(CCCCNCCCN([Si](C)(C)C)[Si](C)(C)C)C(=O)OCC(=O)NCCCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	5720.7	Standard polar	33892256
Tresperimus,5TMS,isomer #14	C[Si](C)(C)N(CCCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)C(=O)COC(=O)NCCCCNCCCN([Si](C)(C)C)[Si](C)(C)C	3994.9	Semi standard non polar	33892256
Tresperimus,5TMS,isomer #14	C[Si](C)(C)N(CCCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)C(=O)COC(=O)NCCCCNCCCN([Si](C)(C)C)[Si](C)(C)C	3591.4	Standard non polar	33892256
Tresperimus,5TMS,isomer #14	C[Si](C)(C)N(CCCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)C(=O)COC(=O)NCCCCNCCCN([Si](C)(C)C)[Si](C)(C)C	5739.6	Standard polar	33892256
Tresperimus,5TMS,isomer #15	C[Si](C)(C)NC(N)=NCCCCCCN(C(=O)COC(=O)N(CCCCNCCCN([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3881.2	Semi standard non polar	33892256
Tresperimus,5TMS,isomer #15	C[Si](C)(C)NC(N)=NCCCCCCN(C(=O)COC(=O)N(CCCCNCCCN([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3490.1	Standard non polar	33892256
Tresperimus,5TMS,isomer #15	C[Si](C)(C)NC(N)=NCCCCCCN(C(=O)COC(=O)N(CCCCNCCCN([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	5807.5	Standard polar	33892256
Tresperimus,5TMS,isomer #16	C[Si](C)(C)NC(N)=NCCCCCCN(C(=O)COC(=O)NCCCCN(CCCN([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4025.2	Semi standard non polar	33892256
Tresperimus,5TMS,isomer #16	C[Si](C)(C)NC(N)=NCCCCCCN(C(=O)COC(=O)NCCCCN(CCCN([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3518.7	Standard non polar	33892256
Tresperimus,5TMS,isomer #16	C[Si](C)(C)NC(N)=NCCCCCCN(C(=O)COC(=O)NCCCCN(CCCN([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	5874.0	Standard polar	33892256
Tresperimus,5TMS,isomer #17	C[Si](C)(C)NC(N)=NCCCCCCNC(=O)COC(=O)N(CCCCN(CCCN([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3986.8	Semi standard non polar	33892256
Tresperimus,5TMS,isomer #17	C[Si](C)(C)NC(N)=NCCCCCCNC(=O)COC(=O)N(CCCCN(CCCN([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3485.6	Standard non polar	33892256
Tresperimus,5TMS,isomer #17	C[Si](C)(C)NC(N)=NCCCCCCNC(=O)COC(=O)N(CCCCN(CCCN([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	5852.3	Standard polar	33892256
Tresperimus,5TMS,isomer #18	C[Si](C)(C)NCCCN(CCCCN(C(=O)OCC(=O)N(CCCCCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3765.5	Semi standard non polar	33892256
Tresperimus,5TMS,isomer #18	C[Si](C)(C)NCCCN(CCCCN(C(=O)OCC(=O)N(CCCCCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3434.0	Standard non polar	33892256
Tresperimus,5TMS,isomer #18	C[Si](C)(C)NCCCN(CCCCN(C(=O)OCC(=O)N(CCCCCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	5811.7	Standard polar	33892256
Tresperimus,5TMS,isomer #19	C[Si](C)(C)NCCCN(CCCCN(C(=O)OCC(=O)NCCCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3832.0	Semi standard non polar	33892256
Tresperimus,5TMS,isomer #19	C[Si](C)(C)NCCCN(CCCCN(C(=O)OCC(=O)NCCCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3468.3	Standard non polar	33892256
Tresperimus,5TMS,isomer #19	C[Si](C)(C)NCCCN(CCCCN(C(=O)OCC(=O)NCCCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	5725.9	Standard polar	33892256
Tresperimus,5TMS,isomer #2	C[Si](C)(C)NC(=NCCCCCCN(C(=O)COC(=O)NCCCCNCCCN([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	4081.0	Semi standard non polar	33892256
Tresperimus,5TMS,isomer #2	C[Si](C)(C)NC(=NCCCCCCN(C(=O)COC(=O)NCCCCNCCCN([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	3428.5	Standard non polar	33892256
Tresperimus,5TMS,isomer #2	C[Si](C)(C)NC(=NCCCCCCN(C(=O)COC(=O)NCCCCNCCCN([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	5184.3	Standard polar	33892256
Tresperimus,5TMS,isomer #20	C[Si](C)(C)NCCCN(CCCCNC(=O)OCC(=O)N(CCCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3868.5	Semi standard non polar	33892256
Tresperimus,5TMS,isomer #20	C[Si](C)(C)NCCCN(CCCCNC(=O)OCC(=O)N(CCCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3516.1	Standard non polar	33892256
Tresperimus,5TMS,isomer #20	C[Si](C)(C)NCCCN(CCCCNC(=O)OCC(=O)N(CCCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	5745.1	Standard polar	33892256
Tresperimus,5TMS,isomer #21	C[Si](C)(C)NCCCNCCCCN(C(=O)OCC(=O)N(CCCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3770.8	Semi standard non polar	33892256
Tresperimus,5TMS,isomer #21	C[Si](C)(C)NCCCNCCCCN(C(=O)OCC(=O)N(CCCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3495.8	Standard non polar	33892256
Tresperimus,5TMS,isomer #21	C[Si](C)(C)NCCCNCCCCN(C(=O)OCC(=O)N(CCCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	5678.1	Standard polar	33892256
Tresperimus,5TMS,isomer #22	C[Si](C)(C)N(CCCCN(C(=O)OCC(=O)N(CCCCCCN=C(N)N)[Si](C)(C)C)[Si](C)(C)C)CCCN([Si](C)(C)C)[Si](C)(C)C	3816.3	Semi standard non polar	33892256
Tresperimus,5TMS,isomer #22	C[Si](C)(C)N(CCCCN(C(=O)OCC(=O)N(CCCCCCN=C(N)N)[Si](C)(C)C)[Si](C)(C)C)CCCN([Si](C)(C)C)[Si](C)(C)C	3529.5	Standard non polar	33892256
Tresperimus,5TMS,isomer #22	C[Si](C)(C)N(CCCCN(C(=O)OCC(=O)N(CCCCCCN=C(N)N)[Si](C)(C)C)[Si](C)(C)C)CCCN([Si](C)(C)C)[Si](C)(C)C	6109.1	Standard polar	33892256
Tresperimus,5TMS,isomer #23	C[Si](C)(C)N(CCCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)C(=O)COC(=O)NCCCCNCCCN	3819.6	Semi standard non polar	33892256
Tresperimus,5TMS,isomer #23	C[Si](C)(C)N(CCCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)C(=O)COC(=O)NCCCCNCCCN	3576.2	Standard non polar	33892256
Tresperimus,5TMS,isomer #23	C[Si](C)(C)N(CCCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)C(=O)COC(=O)NCCCCNCCCN	5180.2	Standard polar	33892256
Tresperimus,5TMS,isomer #24	C[Si](C)(C)N(CCCCNCCCN)C(=O)OCC(=O)NCCCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3778.1	Semi standard non polar	33892256
Tresperimus,5TMS,isomer #24	C[Si](C)(C)N(CCCCNCCCN)C(=O)OCC(=O)NCCCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3527.9	Standard non polar	33892256
Tresperimus,5TMS,isomer #24	C[Si](C)(C)N(CCCCNCCCN)C(=O)OCC(=O)NCCCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	5152.5	Standard polar	33892256
Tresperimus,5TMS,isomer #25	C[Si](C)(C)N(CCCN)CCCCNC(=O)OCC(=O)NCCCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3860.0	Semi standard non polar	33892256
Tresperimus,5TMS,isomer #25	C[Si](C)(C)N(CCCN)CCCCNC(=O)OCC(=O)NCCCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3543.5	Standard non polar	33892256
Tresperimus,5TMS,isomer #25	C[Si](C)(C)N(CCCN)CCCCNC(=O)OCC(=O)NCCCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	5227.7	Standard polar	33892256
Tresperimus,5TMS,isomer #26	C[Si](C)(C)NC(=NCCCCCCN(C(=O)COC(=O)N(CCCCNCCCN)[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3734.6	Semi standard non polar	33892256
Tresperimus,5TMS,isomer #26	C[Si](C)(C)NC(=NCCCCCCN(C(=O)COC(=O)N(CCCCNCCCN)[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3375.5	Standard non polar	33892256
Tresperimus,5TMS,isomer #26	C[Si](C)(C)NC(=NCCCCCCN(C(=O)COC(=O)N(CCCCNCCCN)[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	5362.4	Standard polar	33892256
Tresperimus,5TMS,isomer #27	C[Si](C)(C)NC(=NCCCCCCN(C(=O)COC(=O)NCCCCN(CCCN)[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3831.1	Semi standard non polar	33892256
Tresperimus,5TMS,isomer #27	C[Si](C)(C)NC(=NCCCCCCN(C(=O)COC(=O)NCCCCN(CCCN)[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3394.0	Standard non polar	33892256
Tresperimus,5TMS,isomer #27	C[Si](C)(C)NC(=NCCCCCCN(C(=O)COC(=O)NCCCCN(CCCN)[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	5433.3	Standard polar	33892256
Tresperimus,5TMS,isomer #28	C[Si](C)(C)NC(=NCCCCCCNC(=O)COC(=O)N(CCCCN(CCCN)[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3785.7	Semi standard non polar	33892256
Tresperimus,5TMS,isomer #28	C[Si](C)(C)NC(=NCCCCCCNC(=O)COC(=O)N(CCCCN(CCCN)[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3342.0	Standard non polar	33892256
Tresperimus,5TMS,isomer #28	C[Si](C)(C)NC(=NCCCCCCNC(=O)COC(=O)N(CCCCN(CCCN)[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	5408.6	Standard polar	33892256
Tresperimus,5TMS,isomer #29	C[Si](C)(C)NC(=NCCCCCCN(C(=O)COC(=O)N(CCCCN(CCCN)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	3774.0	Semi standard non polar	33892256
Tresperimus,5TMS,isomer #29	C[Si](C)(C)NC(=NCCCCCCN(C(=O)COC(=O)N(CCCCN(CCCN)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	3224.1	Standard non polar	33892256
Tresperimus,5TMS,isomer #29	C[Si](C)(C)NC(=NCCCCCCN(C(=O)COC(=O)N(CCCCN(CCCN)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	5606.8	Standard polar	33892256
Tresperimus,5TMS,isomer #3	C[Si](C)(C)NC(=NCCCCCCNC(=O)COC(=O)N(CCCCNCCCN([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	4032.6	Semi standard non polar	33892256
Tresperimus,5TMS,isomer #3	C[Si](C)(C)NC(=NCCCCCCNC(=O)COC(=O)N(CCCCNCCCN([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	3386.3	Standard non polar	33892256
Tresperimus,5TMS,isomer #3	C[Si](C)(C)NC(=NCCCCCCNC(=O)COC(=O)N(CCCCNCCCN([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	5160.0	Standard polar	33892256
Tresperimus,5TMS,isomer #30	C[Si](C)(C)N(CCCN)CCCCN(C(=O)OCC(=O)N(CCCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3715.5	Semi standard non polar	33892256
Tresperimus,5TMS,isomer #30	C[Si](C)(C)N(CCCN)CCCCN(C(=O)OCC(=O)N(CCCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3395.6	Standard non polar	33892256
Tresperimus,5TMS,isomer #30	C[Si](C)(C)N(CCCN)CCCCN(C(=O)OCC(=O)N(CCCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	6120.9	Standard polar	33892256
Tresperimus,5TMS,isomer #4	C[Si](C)(C)NC(=NCCCCCCNC(=O)COC(=O)NCCCCN(CCCN([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	4165.1	Semi standard non polar	33892256
Tresperimus,5TMS,isomer #4	C[Si](C)(C)NC(=NCCCCCCNC(=O)COC(=O)NCCCCN(CCCN([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	3404.7	Standard non polar	33892256
Tresperimus,5TMS,isomer #4	C[Si](C)(C)NC(=NCCCCCCNC(=O)COC(=O)NCCCCN(CCCN([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	5266.3	Standard polar	33892256
Tresperimus,5TMS,isomer #5	C[Si](C)(C)NCCCN(CCCCN(C(=O)OCC(=O)NCCCCCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3951.2	Semi standard non polar	33892256
Tresperimus,5TMS,isomer #5	C[Si](C)(C)NCCCN(CCCCN(C(=O)OCC(=O)NCCCCCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3312.5	Standard non polar	33892256
Tresperimus,5TMS,isomer #5	C[Si](C)(C)NCCCN(CCCCN(C(=O)OCC(=O)NCCCCCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	5197.6	Standard polar	33892256
Tresperimus,5TMS,isomer #6	C[Si](C)(C)NCCCN(CCCCNC(=O)OCC(=O)N(CCCCCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3992.3	Semi standard non polar	33892256
Tresperimus,5TMS,isomer #6	C[Si](C)(C)NCCCN(CCCCNC(=O)OCC(=O)N(CCCCCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3361.1	Standard non polar	33892256
Tresperimus,5TMS,isomer #6	C[Si](C)(C)NCCCN(CCCCNC(=O)OCC(=O)N(CCCCCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	5222.4	Standard polar	33892256
Tresperimus,5TMS,isomer #7	C[Si](C)(C)NCCCN(CCCCNC(=O)OCC(=O)NCCCCCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3982.8	Semi standard non polar	33892256
Tresperimus,5TMS,isomer #7	C[Si](C)(C)NCCCN(CCCCNC(=O)OCC(=O)NCCCCCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3508.5	Standard non polar	33892256
Tresperimus,5TMS,isomer #7	C[Si](C)(C)NCCCN(CCCCNC(=O)OCC(=O)NCCCCCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4915.4	Standard polar	33892256
Tresperimus,5TMS,isomer #8	C[Si](C)(C)NCCCNCCCCN(C(=O)OCC(=O)N(CCCCCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3880.5	Semi standard non polar	33892256
Tresperimus,5TMS,isomer #8	C[Si](C)(C)NCCCNCCCCN(C(=O)OCC(=O)N(CCCCCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3359.9	Standard non polar	33892256
Tresperimus,5TMS,isomer #8	C[Si](C)(C)NCCCNCCCCN(C(=O)OCC(=O)N(CCCCCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	5118.0	Standard polar	33892256
Tresperimus,5TMS,isomer #9	C[Si](C)(C)NCCCNCCCCN(C(=O)OCC(=O)NCCCCCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3866.6	Semi standard non polar	33892256
Tresperimus,5TMS,isomer #9	C[Si](C)(C)NCCCNCCCCN(C(=O)OCC(=O)NCCCCCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3510.6	Standard non polar	33892256
Tresperimus,5TMS,isomer #9	C[Si](C)(C)NCCCNCCCCN(C(=O)OCC(=O)NCCCCCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4798.2	Standard polar	33892256
Tresperimus,6TMS,isomer #1	C[Si](C)(C)N(CCCNCCCCNC(=O)OCC(=O)NCCCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4085.8	Semi standard non polar	33892256
Tresperimus,6TMS,isomer #1	C[Si](C)(C)N(CCCNCCCCNC(=O)OCC(=O)NCCCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3700.9	Standard non polar	33892256
Tresperimus,6TMS,isomer #1	C[Si](C)(C)N(CCCNCCCCNC(=O)OCC(=O)NCCCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4300.6	Standard polar	33892256
Tresperimus,6TMS,isomer #10	C[Si](C)(C)NCCCN(CCCCNC(=O)OCC(=O)N(CCCCCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3906.2	Semi standard non polar	33892256
Tresperimus,6TMS,isomer #10	C[Si](C)(C)NCCCN(CCCCNC(=O)OCC(=O)N(CCCCCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3447.4	Standard non polar	33892256
Tresperimus,6TMS,isomer #10	C[Si](C)(C)NCCCN(CCCCNC(=O)OCC(=O)N(CCCCCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4621.1	Standard polar	33892256
Tresperimus,6TMS,isomer #11	C[Si](C)(C)NCCCN(CCCCNC(=O)OCC(=O)NCCCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3936.4	Semi standard non polar	33892256
Tresperimus,6TMS,isomer #11	C[Si](C)(C)NCCCN(CCCCNC(=O)OCC(=O)NCCCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3599.7	Standard non polar	33892256
Tresperimus,6TMS,isomer #11	C[Si](C)(C)NCCCN(CCCCNC(=O)OCC(=O)NCCCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4338.4	Standard polar	33892256
Tresperimus,6TMS,isomer #12	C[Si](C)(C)NCCCNCCCCN(C(=O)OCC(=O)N(CCCCCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3794.7	Semi standard non polar	33892256
Tresperimus,6TMS,isomer #12	C[Si](C)(C)NCCCNCCCCN(C(=O)OCC(=O)N(CCCCCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3460.9	Standard non polar	33892256
Tresperimus,6TMS,isomer #12	C[Si](C)(C)NCCCNCCCCN(C(=O)OCC(=O)N(CCCCCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4509.4	Standard polar	33892256
Tresperimus,6TMS,isomer #13	C[Si](C)(C)NCCCNCCCCN(C(=O)OCC(=O)NCCCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3824.8	Semi standard non polar	33892256
Tresperimus,6TMS,isomer #13	C[Si](C)(C)NCCCNCCCCN(C(=O)OCC(=O)NCCCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3616.8	Standard non polar	33892256
Tresperimus,6TMS,isomer #13	C[Si](C)(C)NCCCNCCCCN(C(=O)OCC(=O)NCCCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4219.7	Standard polar	33892256
Tresperimus,6TMS,isomer #14	C[Si](C)(C)NCCCNCCCCNC(=O)OCC(=O)N(CCCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3883.5	Semi standard non polar	33892256
Tresperimus,6TMS,isomer #14	C[Si](C)(C)NCCCNCCCCNC(=O)OCC(=O)N(CCCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3663.2	Standard non polar	33892256
Tresperimus,6TMS,isomer #14	C[Si](C)(C)NCCCNCCCCNC(=O)OCC(=O)N(CCCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4252.7	Standard polar	33892256
Tresperimus,6TMS,isomer #15	C[Si](C)(C)N(CCCCN(C(=O)OCC(=O)NCCCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)CCCN([Si](C)(C)C)[Si](C)(C)C	4030.7	Semi standard non polar	33892256
Tresperimus,6TMS,isomer #15	C[Si](C)(C)N(CCCCN(C(=O)OCC(=O)NCCCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)CCCN([Si](C)(C)C)[Si](C)(C)C	3509.9	Standard non polar	33892256
Tresperimus,6TMS,isomer #15	C[Si](C)(C)N(CCCCN(C(=O)OCC(=O)NCCCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)CCCN([Si](C)(C)C)[Si](C)(C)C	5585.7	Standard polar	33892256
Tresperimus,6TMS,isomer #16	C[Si](C)(C)N(CCCCNC(=O)OCC(=O)N(CCCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)CCCN([Si](C)(C)C)[Si](C)(C)C	4059.0	Semi standard non polar	33892256
Tresperimus,6TMS,isomer #16	C[Si](C)(C)N(CCCCNC(=O)OCC(=O)N(CCCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)CCCN([Si](C)(C)C)[Si](C)(C)C	3553.3	Standard non polar	33892256
Tresperimus,6TMS,isomer #16	C[Si](C)(C)N(CCCCNC(=O)OCC(=O)N(CCCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)CCCN([Si](C)(C)C)[Si](C)(C)C	5607.1	Standard polar	33892256
Tresperimus,6TMS,isomer #17	C[Si](C)(C)N(CCCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)C(=O)COC(=O)N(CCCCNCCCN([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3933.2	Semi standard non polar	33892256
Tresperimus,6TMS,isomer #17	C[Si](C)(C)N(CCCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)C(=O)COC(=O)N(CCCCNCCCN([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3527.1	Standard non polar	33892256
Tresperimus,6TMS,isomer #17	C[Si](C)(C)N(CCCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)C(=O)COC(=O)N(CCCCNCCCN([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	5541.2	Standard polar	33892256
Tresperimus,6TMS,isomer #18	C[Si](C)(C)NC(N)=NCCCCCCN(C(=O)COC(=O)N(CCCCN(CCCN([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3955.5	Semi standard non polar	33892256
Tresperimus,6TMS,isomer #18	C[Si](C)(C)NC(N)=NCCCCCCN(C(=O)COC(=O)N(CCCCN(CCCN([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3487.9	Standard non polar	33892256
Tresperimus,6TMS,isomer #18	C[Si](C)(C)NC(N)=NCCCCCCN(C(=O)COC(=O)N(CCCCN(CCCN([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	5655.0	Standard polar	33892256
Tresperimus,6TMS,isomer #19	C[Si](C)(C)NCCCN(CCCCN(C(=O)OCC(=O)N(CCCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3807.3	Semi standard non polar	33892256
Tresperimus,6TMS,isomer #19	C[Si](C)(C)NCCCN(CCCCN(C(=O)OCC(=O)N(CCCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3458.5	Standard non polar	33892256
Tresperimus,6TMS,isomer #19	C[Si](C)(C)NCCCN(CCCCN(C(=O)OCC(=O)N(CCCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	5547.8	Standard polar	33892256
Tresperimus,6TMS,isomer #2	C[Si](C)(C)NC(=NCCCCCCN(C(=O)COC(=O)NCCCCNCCCN([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	4050.5	Semi standard non polar	33892256
Tresperimus,6TMS,isomer #2	C[Si](C)(C)NC(=NCCCCCCN(C(=O)COC(=O)NCCCCNCCCN([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3533.7	Standard non polar	33892256
Tresperimus,6TMS,isomer #2	C[Si](C)(C)NC(=NCCCCCCN(C(=O)COC(=O)NCCCCNCCCN([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	4582.5	Standard polar	33892256
Tresperimus,6TMS,isomer #20	C[Si](C)(C)N(CCCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)C(=O)COC(=O)N(CCCCNCCCN)[Si](C)(C)C	3758.1	Semi standard non polar	33892256
Tresperimus,6TMS,isomer #20	C[Si](C)(C)N(CCCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)C(=O)COC(=O)N(CCCCNCCCN)[Si](C)(C)C	3506.7	Standard non polar	33892256
Tresperimus,6TMS,isomer #20	C[Si](C)(C)N(CCCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)C(=O)COC(=O)N(CCCCNCCCN)[Si](C)(C)C	4904.7	Standard polar	33892256
Tresperimus,6TMS,isomer #21	C[Si](C)(C)N(CCCN)CCCCNC(=O)OCC(=O)N(CCCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3828.2	Semi standard non polar	33892256
Tresperimus,6TMS,isomer #21	C[Si](C)(C)N(CCCN)CCCCNC(=O)OCC(=O)N(CCCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3508.2	Standard non polar	33892256
Tresperimus,6TMS,isomer #21	C[Si](C)(C)N(CCCN)CCCCNC(=O)OCC(=O)N(CCCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4978.1	Standard polar	33892256
Tresperimus,6TMS,isomer #22	C[Si](C)(C)N(CCCN)CCCCN(C(=O)OCC(=O)NCCCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3805.7	Semi standard non polar	33892256
Tresperimus,6TMS,isomer #22	C[Si](C)(C)N(CCCN)CCCCN(C(=O)OCC(=O)NCCCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3464.2	Standard non polar	33892256
Tresperimus,6TMS,isomer #22	C[Si](C)(C)N(CCCN)CCCCN(C(=O)OCC(=O)NCCCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4949.2	Standard polar	33892256
Tresperimus,6TMS,isomer #23	C[Si](C)(C)NC(=NCCCCCCN(C(=O)COC(=O)N(CCCCN(CCCN)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3764.1	Semi standard non polar	33892256
Tresperimus,6TMS,isomer #23	C[Si](C)(C)NC(=NCCCCCCN(C(=O)COC(=O)N(CCCCN(CCCN)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3337.7	Standard non polar	33892256
Tresperimus,6TMS,isomer #23	C[Si](C)(C)NC(=NCCCCCCN(C(=O)COC(=O)N(CCCCN(CCCN)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	5161.8	Standard polar	33892256
Tresperimus,6TMS,isomer #3	C[Si](C)(C)NC(=NCCCCCCNC(=O)COC(=O)N(CCCCNCCCN([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3993.0	Semi standard non polar	33892256
Tresperimus,6TMS,isomer #3	C[Si](C)(C)NC(=NCCCCCCNC(=O)COC(=O)N(CCCCNCCCN([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3487.8	Standard non polar	33892256
Tresperimus,6TMS,isomer #3	C[Si](C)(C)NC(=NCCCCCCNC(=O)COC(=O)N(CCCCNCCCN([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	4550.9	Standard polar	33892256
Tresperimus,6TMS,isomer #4	C[Si](C)(C)NC(=NCCCCCCNC(=O)COC(=O)NCCCCN(CCCN([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	4152.9	Semi standard non polar	33892256
Tresperimus,6TMS,isomer #4	C[Si](C)(C)NC(=NCCCCCCNC(=O)COC(=O)NCCCCN(CCCN([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3498.1	Standard non polar	33892256
Tresperimus,6TMS,isomer #4	C[Si](C)(C)NC(=NCCCCCCNC(=O)COC(=O)NCCCCN(CCCN([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	4667.8	Standard polar	33892256
Tresperimus,6TMS,isomer #5	C[Si](C)(C)NC(=NCCCCCCN(C(=O)COC(=O)N(CCCCNCCCN([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	3980.6	Semi standard non polar	33892256
Tresperimus,6TMS,isomer #5	C[Si](C)(C)NC(=NCCCCCCN(C(=O)COC(=O)N(CCCCNCCCN([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	3371.3	Standard non polar	33892256
Tresperimus,6TMS,isomer #5	C[Si](C)(C)NC(=NCCCCCCN(C(=O)COC(=O)N(CCCCNCCCN([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	4843.7	Standard polar	33892256
Tresperimus,6TMS,isomer #6	C[Si](C)(C)NC(=NCCCCCCN(C(=O)COC(=O)NCCCCN(CCCN([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	4115.6	Semi standard non polar	33892256
Tresperimus,6TMS,isomer #6	C[Si](C)(C)NC(=NCCCCCCN(C(=O)COC(=O)NCCCCN(CCCN([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	3389.3	Standard non polar	33892256
Tresperimus,6TMS,isomer #6	C[Si](C)(C)NC(=NCCCCCCN(C(=O)COC(=O)NCCCCN(CCCN([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	4952.5	Standard polar	33892256
Tresperimus,6TMS,isomer #7	C[Si](C)(C)NC(=NCCCCCCNC(=O)COC(=O)N(CCCCN(CCCN([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	4081.2	Semi standard non polar	33892256
Tresperimus,6TMS,isomer #7	C[Si](C)(C)NC(=NCCCCCCNC(=O)COC(=O)N(CCCCN(CCCN([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	3346.5	Standard non polar	33892256
Tresperimus,6TMS,isomer #7	C[Si](C)(C)NC(=NCCCCCCNC(=O)COC(=O)N(CCCCN(CCCN([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	4923.0	Standard polar	33892256
Tresperimus,6TMS,isomer #8	C[Si](C)(C)NCCCN(CCCCN(C(=O)OCC(=O)N(CCCCCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3857.7	Semi standard non polar	33892256
Tresperimus,6TMS,isomer #8	C[Si](C)(C)NCCCN(CCCCN(C(=O)OCC(=O)N(CCCCCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3308.0	Standard non polar	33892256
Tresperimus,6TMS,isomer #8	C[Si](C)(C)NCCCN(CCCCN(C(=O)OCC(=O)N(CCCCCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4882.2	Standard polar	33892256
Tresperimus,6TMS,isomer #9	C[Si](C)(C)NCCCN(CCCCN(C(=O)OCC(=O)NCCCCCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3855.1	Semi standard non polar	33892256
Tresperimus,6TMS,isomer #9	C[Si](C)(C)NCCCN(CCCCN(C(=O)OCC(=O)NCCCCCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3398.0	Standard non polar	33892256
Tresperimus,6TMS,isomer #9	C[Si](C)(C)NCCCN(CCCCN(C(=O)OCC(=O)NCCCCCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4590.4	Standard polar	33892256
Tresperimus,7TMS,isomer #1	C[Si](C)(C)N(CCCCNC(=O)OCC(=O)NCCCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)CCCN([Si](C)(C)C)[Si](C)(C)C	4162.3	Semi standard non polar	33892256
Tresperimus,7TMS,isomer #1	C[Si](C)(C)N(CCCCNC(=O)OCC(=O)NCCCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)CCCN([Si](C)(C)C)[Si](C)(C)C	3621.4	Standard non polar	33892256
Tresperimus,7TMS,isomer #1	C[Si](C)(C)N(CCCCNC(=O)OCC(=O)NCCCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)CCCN([Si](C)(C)C)[Si](C)(C)C	4153.3	Standard polar	33892256
Tresperimus,7TMS,isomer #10	C[Si](C)(C)NCCCN(CCCCNC(=O)OCC(=O)N(CCCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3905.8	Semi standard non polar	33892256
Tresperimus,7TMS,isomer #10	C[Si](C)(C)NCCCN(CCCCNC(=O)OCC(=O)N(CCCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3570.6	Standard non polar	33892256
Tresperimus,7TMS,isomer #10	C[Si](C)(C)NCCCN(CCCCNC(=O)OCC(=O)N(CCCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4108.9	Standard polar	33892256
Tresperimus,7TMS,isomer #11	C[Si](C)(C)NCCCNCCCCN(C(=O)OCC(=O)N(CCCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3810.4	Semi standard non polar	33892256
Tresperimus,7TMS,isomer #11	C[Si](C)(C)NCCCNCCCCN(C(=O)OCC(=O)N(CCCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3598.2	Standard non polar	33892256
Tresperimus,7TMS,isomer #11	C[Si](C)(C)NCCCNCCCCN(C(=O)OCC(=O)N(CCCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4003.3	Standard polar	33892256
Tresperimus,7TMS,isomer #12	C[Si](C)(C)N(CCCCN(C(=O)OCC(=O)N(CCCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)CCCN([Si](C)(C)C)[Si](C)(C)C	4064.1	Semi standard non polar	33892256
Tresperimus,7TMS,isomer #12	C[Si](C)(C)N(CCCCN(C(=O)OCC(=O)N(CCCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)CCCN([Si](C)(C)C)[Si](C)(C)C	3518.8	Standard non polar	33892256
Tresperimus,7TMS,isomer #12	C[Si](C)(C)N(CCCCN(C(=O)OCC(=O)N(CCCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)CCCN([Si](C)(C)C)[Si](C)(C)C	5412.3	Standard polar	33892256
Tresperimus,7TMS,isomer #13	C[Si](C)(C)N(CCCN)CCCCN(C(=O)OCC(=O)N(CCCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3841.5	Semi standard non polar	33892256
Tresperimus,7TMS,isomer #13	C[Si](C)(C)N(CCCN)CCCCN(C(=O)OCC(=O)N(CCCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3479.0	Standard non polar	33892256
Tresperimus,7TMS,isomer #13	C[Si](C)(C)N(CCCN)CCCCN(C(=O)OCC(=O)N(CCCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4744.5	Standard polar	33892256
Tresperimus,7TMS,isomer #2	C[Si](C)(C)N(CCCCNCCCN([Si](C)(C)C)[Si](C)(C)C)C(=O)OCC(=O)NCCCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	4030.3	Semi standard non polar	33892256
Tresperimus,7TMS,isomer #2	C[Si](C)(C)N(CCCCNCCCN([Si](C)(C)C)[Si](C)(C)C)C(=O)OCC(=O)NCCCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3624.8	Standard non polar	33892256
Tresperimus,7TMS,isomer #2	C[Si](C)(C)N(CCCCNCCCN([Si](C)(C)C)[Si](C)(C)C)C(=O)OCC(=O)NCCCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	4039.8	Standard polar	33892256
Tresperimus,7TMS,isomer #3	C[Si](C)(C)N(CCCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)C(=O)COC(=O)NCCCCNCCCN([Si](C)(C)C)[Si](C)(C)C	4062.5	Semi standard non polar	33892256
Tresperimus,7TMS,isomer #3	C[Si](C)(C)N(CCCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)C(=O)COC(=O)NCCCCNCCCN([Si](C)(C)C)[Si](C)(C)C	3659.3	Standard non polar	33892256
Tresperimus,7TMS,isomer #3	C[Si](C)(C)N(CCCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)C(=O)COC(=O)NCCCCNCCCN([Si](C)(C)C)[Si](C)(C)C	4070.2	Standard polar	33892256
Tresperimus,7TMS,isomer #4	C[Si](C)(C)NC(=NCCCCCCN(C(=O)COC(=O)N(CCCCNCCCN([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3996.4	Semi standard non polar	33892256
Tresperimus,7TMS,isomer #4	C[Si](C)(C)NC(=NCCCCCCN(C(=O)COC(=O)N(CCCCNCCCN([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3480.4	Standard non polar	33892256
Tresperimus,7TMS,isomer #4	C[Si](C)(C)NC(=NCCCCCCN(C(=O)COC(=O)N(CCCCNCCCN([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	4309.7	Standard polar	33892256
Tresperimus,7TMS,isomer #5	C[Si](C)(C)NC(=NCCCCCCN(C(=O)COC(=O)NCCCCN(CCCN([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	4115.7	Semi standard non polar	33892256
Tresperimus,7TMS,isomer #5	C[Si](C)(C)NC(=NCCCCCCN(C(=O)COC(=O)NCCCCN(CCCN([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3483.5	Standard non polar	33892256
Tresperimus,7TMS,isomer #5	C[Si](C)(C)NC(=NCCCCCCN(C(=O)COC(=O)NCCCCN(CCCN([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	4419.3	Standard polar	33892256
Tresperimus,7TMS,isomer #6	C[Si](C)(C)NC(=NCCCCCCNC(=O)COC(=O)N(CCCCN(CCCN([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	4088.4	Semi standard non polar	33892256
Tresperimus,7TMS,isomer #6	C[Si](C)(C)NC(=NCCCCCCNC(=O)COC(=O)N(CCCCN(CCCN([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3443.2	Standard non polar	33892256
Tresperimus,7TMS,isomer #6	C[Si](C)(C)NC(=NCCCCCCNC(=O)COC(=O)N(CCCCN(CCCN([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	4387.8	Standard polar	33892256
Tresperimus,7TMS,isomer #7	C[Si](C)(C)NC(=NCCCCCCN(C(=O)COC(=O)N(CCCCN(CCCN([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	4057.7	Semi standard non polar	33892256
Tresperimus,7TMS,isomer #7	C[Si](C)(C)NC(=NCCCCCCN(C(=O)COC(=O)N(CCCCN(CCCN([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	3370.6	Standard non polar	33892256
Tresperimus,7TMS,isomer #7	C[Si](C)(C)NC(=NCCCCCCN(C(=O)COC(=O)N(CCCCN(CCCN([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	4659.2	Standard polar	33892256
Tresperimus,7TMS,isomer #8	C[Si](C)(C)NCCCN(CCCCN(C(=O)OCC(=O)N(CCCCCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3853.1	Semi standard non polar	33892256
Tresperimus,7TMS,isomer #8	C[Si](C)(C)NCCCN(CCCCN(C(=O)OCC(=O)N(CCCCCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3408.7	Standard non polar	33892256
Tresperimus,7TMS,isomer #8	C[Si](C)(C)NCCCN(CCCCN(C(=O)OCC(=O)N(CCCCCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4348.6	Standard polar	33892256
Tresperimus,7TMS,isomer #9	C[Si](C)(C)NCCCN(CCCCN(C(=O)OCC(=O)NCCCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3875.7	Semi standard non polar	33892256
Tresperimus,7TMS,isomer #9	C[Si](C)(C)NCCCN(CCCCN(C(=O)OCC(=O)NCCCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3532.6	Standard non polar	33892256
Tresperimus,7TMS,isomer #9	C[Si](C)(C)NCCCN(CCCCN(C(=O)OCC(=O)NCCCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4079.6	Standard polar	33892256
Tresperimus,1TBDMS,isomer #1	CC(C)(C)[Si](C)(C)NCCCNCCCCNC(=O)OCC(=O)NCCCCCCN=C(N)N	4061.4	Semi standard non polar	33892256
Tresperimus,1TBDMS,isomer #1	CC(C)(C)[Si](C)(C)NCCCNCCCCNC(=O)OCC(=O)NCCCCCCN=C(N)N	3700.4	Standard non polar	33892256
Tresperimus,1TBDMS,isomer #1	CC(C)(C)[Si](C)(C)NCCCNCCCCNC(=O)OCC(=O)NCCCCCCN=C(N)N	6678.0	Standard polar	33892256
Tresperimus,1TBDMS,isomer #2	CC(C)(C)[Si](C)(C)NC(N)=NCCCCCCNC(=O)COC(=O)NCCCCNCCCN	4082.5	Semi standard non polar	33892256
Tresperimus,1TBDMS,isomer #2	CC(C)(C)[Si](C)(C)NC(N)=NCCCCCCNC(=O)COC(=O)NCCCCNCCCN	3594.3	Standard non polar	33892256
Tresperimus,1TBDMS,isomer #2	CC(C)(C)[Si](C)(C)NC(N)=NCCCCCCNC(=O)COC(=O)NCCCCNCCCN	6776.1	Standard polar	33892256
Tresperimus,1TBDMS,isomer #3	CC(C)(C)[Si](C)(C)N(CCCN)CCCCNC(=O)OCC(=O)NCCCCCCN=C(N)N	3991.6	Semi standard non polar	33892256
Tresperimus,1TBDMS,isomer #3	CC(C)(C)[Si](C)(C)N(CCCN)CCCCNC(=O)OCC(=O)NCCCCCCN=C(N)N	3531.7	Standard non polar	33892256
Tresperimus,1TBDMS,isomer #3	CC(C)(C)[Si](C)(C)N(CCCN)CCCCNC(=O)OCC(=O)NCCCCCCN=C(N)N	6961.3	Standard polar	33892256
Tresperimus,1TBDMS,isomer #4	CC(C)(C)[Si](C)(C)N(CCCCNCCCN)C(=O)OCC(=O)NCCCCCCN=C(N)N	3937.5	Semi standard non polar	33892256
Tresperimus,1TBDMS,isomer #4	CC(C)(C)[Si](C)(C)N(CCCCNCCCN)C(=O)OCC(=O)NCCCCCCN=C(N)N	3495.5	Standard non polar	33892256
Tresperimus,1TBDMS,isomer #4	CC(C)(C)[Si](C)(C)N(CCCCNCCCN)C(=O)OCC(=O)NCCCCCCN=C(N)N	6912.2	Standard polar	33892256
Tresperimus,1TBDMS,isomer #5	CC(C)(C)[Si](C)(C)N(CCCCCCN=C(N)N)C(=O)COC(=O)NCCCCNCCCN	3928.2	Semi standard non polar	33892256
Tresperimus,1TBDMS,isomer #5	CC(C)(C)[Si](C)(C)N(CCCCCCN=C(N)N)C(=O)COC(=O)NCCCCNCCCN	3527.6	Standard non polar	33892256
Tresperimus,1TBDMS,isomer #5	CC(C)(C)[Si](C)(C)N(CCCCCCN=C(N)N)C(=O)COC(=O)NCCCCNCCCN	6921.9	Standard polar	33892256
Tresperimus,2TBDMS,isomer #1	CC(C)(C)[Si](C)(C)NCCCNCCCCNC(=O)OCC(=O)NCCCCCCN=C(N)N[Si](C)(C)C(C)(C)C	4388.8	Semi standard non polar	33892256
Tresperimus,2TBDMS,isomer #1	CC(C)(C)[Si](C)(C)NCCCNCCCCNC(=O)OCC(=O)NCCCCCCN=C(N)N[Si](C)(C)C(C)(C)C	3861.1	Standard non polar	33892256
Tresperimus,2TBDMS,isomer #1	CC(C)(C)[Si](C)(C)NCCCNCCCCNC(=O)OCC(=O)NCCCCCCN=C(N)N[Si](C)(C)C(C)(C)C	6237.8	Standard polar	33892256
Tresperimus,2TBDMS,isomer #10	CC(C)(C)[Si](C)(C)NC(N)=NCCCCCCNC(=O)COC(=O)NCCCCN(CCCN)[Si](C)(C)C(C)(C)C	4273.5	Semi standard non polar	33892256
Tresperimus,2TBDMS,isomer #10	CC(C)(C)[Si](C)(C)NC(N)=NCCCCCCNC(=O)COC(=O)NCCCCN(CCCN)[Si](C)(C)C(C)(C)C	3702.1	Standard non polar	33892256
Tresperimus,2TBDMS,isomer #10	CC(C)(C)[Si](C)(C)NC(N)=NCCCCCCNC(=O)COC(=O)NCCCCN(CCCN)[Si](C)(C)C(C)(C)C	6548.0	Standard polar	33892256
Tresperimus,2TBDMS,isomer #11	CC(C)(C)[Si](C)(C)N(CCCN)CCCCN(C(=O)OCC(=O)NCCCCCCN=C(N)N)[Si](C)(C)C(C)(C)C	4135.9	Semi standard non polar	33892256
Tresperimus,2TBDMS,isomer #11	CC(C)(C)[Si](C)(C)N(CCCN)CCCCN(C(=O)OCC(=O)NCCCCCCN=C(N)N)[Si](C)(C)C(C)(C)C	3679.0	Standard non polar	33892256
Tresperimus,2TBDMS,isomer #11	CC(C)(C)[Si](C)(C)N(CCCN)CCCCN(C(=O)OCC(=O)NCCCCCCN=C(N)N)[Si](C)(C)C(C)(C)C	6738.3	Standard polar	33892256
Tresperimus,2TBDMS,isomer #12	CC(C)(C)[Si](C)(C)N(CCCN)CCCCNC(=O)OCC(=O)N(CCCCCCN=C(N)N)[Si](C)(C)C(C)(C)C	4110.0	Semi standard non polar	33892256
Tresperimus,2TBDMS,isomer #12	CC(C)(C)[Si](C)(C)N(CCCN)CCCCNC(=O)OCC(=O)N(CCCCCCN=C(N)N)[Si](C)(C)C(C)(C)C	3700.4	Standard non polar	33892256
Tresperimus,2TBDMS,isomer #12	CC(C)(C)[Si](C)(C)N(CCCN)CCCCNC(=O)OCC(=O)N(CCCCCCN=C(N)N)[Si](C)(C)C(C)(C)C	6750.2	Standard polar	33892256
Tresperimus,2TBDMS,isomer #13	CC(C)(C)[Si](C)(C)N(CCCCCCN=C(N)N)C(=O)COC(=O)N(CCCCNCCCN)[Si](C)(C)C(C)(C)C	4052.9	Semi standard non polar	33892256
Tresperimus,2TBDMS,isomer #13	CC(C)(C)[Si](C)(C)N(CCCCCCN=C(N)N)C(=O)COC(=O)N(CCCCNCCCN)[Si](C)(C)C(C)(C)C	3675.4	Standard non polar	33892256
Tresperimus,2TBDMS,isomer #13	CC(C)(C)[Si](C)(C)N(CCCCCCN=C(N)N)C(=O)COC(=O)N(CCCCNCCCN)[Si](C)(C)C(C)(C)C	6698.1	Standard polar	33892256
Tresperimus,2TBDMS,isomer #2	CC(C)(C)[Si](C)(C)N(CCCNCCCCNC(=O)OCC(=O)NCCCCCCN=C(N)N)[Si](C)(C)C(C)(C)C	4356.8	Semi standard non polar	33892256
Tresperimus,2TBDMS,isomer #2	CC(C)(C)[Si](C)(C)N(CCCNCCCCNC(=O)OCC(=O)NCCCCCCN=C(N)N)[Si](C)(C)C(C)(C)C	3850.3	Standard non polar	33892256
Tresperimus,2TBDMS,isomer #2	CC(C)(C)[Si](C)(C)N(CCCNCCCCNC(=O)OCC(=O)NCCCCCCN=C(N)N)[Si](C)(C)C(C)(C)C	6490.2	Standard polar	33892256
Tresperimus,2TBDMS,isomer #3	CC(C)(C)[Si](C)(C)NCCCN(CCCCNC(=O)OCC(=O)NCCCCCCN=C(N)N)[Si](C)(C)C(C)(C)C	4287.1	Semi standard non polar	33892256
Tresperimus,2TBDMS,isomer #3	CC(C)(C)[Si](C)(C)NCCCN(CCCCNC(=O)OCC(=O)NCCCCCCN=C(N)N)[Si](C)(C)C(C)(C)C	3800.2	Standard non polar	33892256
Tresperimus,2TBDMS,isomer #3	CC(C)(C)[Si](C)(C)NCCCN(CCCCNC(=O)OCC(=O)NCCCCCCN=C(N)N)[Si](C)(C)C(C)(C)C	6487.8	Standard polar	33892256
Tresperimus,2TBDMS,isomer #4	CC(C)(C)[Si](C)(C)NCCCNCCCCN(C(=O)OCC(=O)NCCCCCCN=C(N)N)[Si](C)(C)C(C)(C)C	4221.8	Semi standard non polar	33892256
Tresperimus,2TBDMS,isomer #4	CC(C)(C)[Si](C)(C)NCCCNCCCCN(C(=O)OCC(=O)NCCCCCCN=C(N)N)[Si](C)(C)C(C)(C)C	3775.8	Standard non polar	33892256
Tresperimus,2TBDMS,isomer #4	CC(C)(C)[Si](C)(C)NCCCNCCCCN(C(=O)OCC(=O)NCCCCCCN=C(N)N)[Si](C)(C)C(C)(C)C	6413.0	Standard polar	33892256
Tresperimus,2TBDMS,isomer #5	CC(C)(C)[Si](C)(C)NCCCNCCCCNC(=O)OCC(=O)N(CCCCCCN=C(N)N)[Si](C)(C)C(C)(C)C	4198.6	Semi standard non polar	33892256
Tresperimus,2TBDMS,isomer #5	CC(C)(C)[Si](C)(C)NCCCNCCCCNC(=O)OCC(=O)N(CCCCCCN=C(N)N)[Si](C)(C)C(C)(C)C	3800.6	Standard non polar	33892256
Tresperimus,2TBDMS,isomer #5	CC(C)(C)[Si](C)(C)NCCCNCCCCNC(=O)OCC(=O)N(CCCCCCN=C(N)N)[Si](C)(C)C(C)(C)C	6422.2	Standard polar	33892256
Tresperimus,2TBDMS,isomer #6	CC(C)(C)[Si](C)(C)NC(=NCCCCCCNC(=O)COC(=O)NCCCCNCCCN)N[Si](C)(C)C(C)(C)C	4417.6	Semi standard non polar	33892256
Tresperimus,2TBDMS,isomer #6	CC(C)(C)[Si](C)(C)NC(=NCCCCCCNC(=O)COC(=O)NCCCCNCCCN)N[Si](C)(C)C(C)(C)C	3693.5	Standard non polar	33892256
Tresperimus,2TBDMS,isomer #6	CC(C)(C)[Si](C)(C)NC(=NCCCCCCNC(=O)COC(=O)NCCCCNCCCN)N[Si](C)(C)C(C)(C)C	6073.3	Standard polar	33892256
Tresperimus,2TBDMS,isomer #7	CC(C)(C)[Si](C)(C)N(C(N)=NCCCCCCNC(=O)COC(=O)NCCCCNCCCN)[Si](C)(C)C(C)(C)C	4231.2	Semi standard non polar	33892256
Tresperimus,2TBDMS,isomer #7	CC(C)(C)[Si](C)(C)N(C(N)=NCCCCCCNC(=O)COC(=O)NCCCCNCCCN)[Si](C)(C)C(C)(C)C	3804.3	Standard non polar	33892256
Tresperimus,2TBDMS,isomer #7	CC(C)(C)[Si](C)(C)N(C(N)=NCCCCCCNC(=O)COC(=O)NCCCCNCCCN)[Si](C)(C)C(C)(C)C	6440.0	Standard polar	33892256
Tresperimus,2TBDMS,isomer #8	CC(C)(C)[Si](C)(C)NC(N)=NCCCCCCN(C(=O)COC(=O)NCCCCNCCCN)[Si](C)(C)C(C)(C)C	4236.1	Semi standard non polar	33892256
Tresperimus,2TBDMS,isomer #8	CC(C)(C)[Si](C)(C)NC(N)=NCCCCCCN(C(=O)COC(=O)NCCCCNCCCN)[Si](C)(C)C(C)(C)C	3716.2	Standard non polar	33892256
Tresperimus,2TBDMS,isomer #8	CC(C)(C)[Si](C)(C)NC(N)=NCCCCCCN(C(=O)COC(=O)NCCCCNCCCN)[Si](C)(C)C(C)(C)C	6502.4	Standard polar	33892256
Tresperimus,2TBDMS,isomer #9	CC(C)(C)[Si](C)(C)NC(N)=NCCCCCCNC(=O)COC(=O)N(CCCCNCCCN)[Si](C)(C)C(C)(C)C	4232.3	Semi standard non polar	33892256
Tresperimus,2TBDMS,isomer #9	CC(C)(C)[Si](C)(C)NC(N)=NCCCCCCNC(=O)COC(=O)N(CCCCNCCCN)[Si](C)(C)C(C)(C)C	3676.2	Standard non polar	33892256
Tresperimus,2TBDMS,isomer #9	CC(C)(C)[Si](C)(C)NC(N)=NCCCCCCNC(=O)COC(=O)N(CCCCNCCCN)[Si](C)(C)C(C)(C)C	6493.4	Standard polar	33892256
Tresperimus,3TBDMS,isomer #1	CC(C)(C)[Si](C)(C)NCCCNCCCCNC(=O)OCC(=O)NCCCCCCN=C(N[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C	4705.3	Semi standard non polar	33892256
Tresperimus,3TBDMS,isomer #1	CC(C)(C)[Si](C)(C)NCCCNCCCCNC(=O)OCC(=O)NCCCCCCN=C(N[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C	3941.5	Standard non polar	33892256
Tresperimus,3TBDMS,isomer #1	CC(C)(C)[Si](C)(C)NCCCNCCCCNC(=O)OCC(=O)NCCCCCCN=C(N[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C	5425.7	Standard polar	33892256
Tresperimus,3TBDMS,isomer #10	CC(C)(C)[Si](C)(C)NCCCN(CCCCN(C(=O)OCC(=O)NCCCCCCN=C(N)N)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4453.7	Semi standard non polar	33892256
Tresperimus,3TBDMS,isomer #10	CC(C)(C)[Si](C)(C)NCCCN(CCCCN(C(=O)OCC(=O)NCCCCCCN=C(N)N)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3922.9	Standard non polar	33892256
Tresperimus,3TBDMS,isomer #10	CC(C)(C)[Si](C)(C)NCCCN(CCCCN(C(=O)OCC(=O)NCCCCCCN=C(N)N)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	6248.1	Standard polar	33892256
Tresperimus,3TBDMS,isomer #11	CC(C)(C)[Si](C)(C)NCCCN(CCCCNC(=O)OCC(=O)N(CCCCCCN=C(N)N)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4431.4	Semi standard non polar	33892256
Tresperimus,3TBDMS,isomer #11	CC(C)(C)[Si](C)(C)NCCCN(CCCCNC(=O)OCC(=O)N(CCCCCCN=C(N)N)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3935.6	Standard non polar	33892256
Tresperimus,3TBDMS,isomer #11	CC(C)(C)[Si](C)(C)NCCCN(CCCCNC(=O)OCC(=O)N(CCCCCCN=C(N)N)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	6261.7	Standard polar	33892256
Tresperimus,3TBDMS,isomer #12	CC(C)(C)[Si](C)(C)NCCCNCCCCN(C(=O)OCC(=O)N(CCCCCCN=C(N)N)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4354.0	Semi standard non polar	33892256
Tresperimus,3TBDMS,isomer #12	CC(C)(C)[Si](C)(C)NCCCNCCCCN(C(=O)OCC(=O)N(CCCCCCN=C(N)N)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3915.8	Standard non polar	33892256
Tresperimus,3TBDMS,isomer #12	CC(C)(C)[Si](C)(C)NCCCNCCCCN(C(=O)OCC(=O)N(CCCCCCN=C(N)N)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	6194.7	Standard polar	33892256
Tresperimus,3TBDMS,isomer #13	CC(C)(C)[Si](C)(C)NC(=NCCCCCCNC(=O)COC(=O)NCCCCNCCCN)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4528.3	Semi standard non polar	33892256
Tresperimus,3TBDMS,isomer #13	CC(C)(C)[Si](C)(C)NC(=NCCCCCCNC(=O)COC(=O)NCCCCNCCCN)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3943.0	Standard non polar	33892256
Tresperimus,3TBDMS,isomer #13	CC(C)(C)[Si](C)(C)NC(=NCCCCCCNC(=O)COC(=O)NCCCCNCCCN)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	5570.9	Standard polar	33892256
Tresperimus,3TBDMS,isomer #14	CC(C)(C)[Si](C)(C)NC(=NCCCCCCN(C(=O)COC(=O)NCCCCNCCCN)[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C	4562.0	Semi standard non polar	33892256
Tresperimus,3TBDMS,isomer #14	CC(C)(C)[Si](C)(C)NC(=NCCCCCCN(C(=O)COC(=O)NCCCCNCCCN)[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C	3768.6	Standard non polar	33892256
Tresperimus,3TBDMS,isomer #14	CC(C)(C)[Si](C)(C)NC(=NCCCCCCN(C(=O)COC(=O)NCCCCNCCCN)[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C	5739.7	Standard polar	33892256
Tresperimus,3TBDMS,isomer #15	CC(C)(C)[Si](C)(C)NC(=NCCCCCCNC(=O)COC(=O)N(CCCCNCCCN)[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C	4554.4	Semi standard non polar	33892256
Tresperimus,3TBDMS,isomer #15	CC(C)(C)[Si](C)(C)NC(=NCCCCCCNC(=O)COC(=O)N(CCCCNCCCN)[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C	3740.7	Standard non polar	33892256
Tresperimus,3TBDMS,isomer #15	CC(C)(C)[Si](C)(C)NC(=NCCCCCCNC(=O)COC(=O)N(CCCCNCCCN)[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C	5723.0	Standard polar	33892256
Tresperimus,3TBDMS,isomer #16	CC(C)(C)[Si](C)(C)NC(=NCCCCCCNC(=O)COC(=O)NCCCCN(CCCN)[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C	4589.5	Semi standard non polar	33892256
Tresperimus,3TBDMS,isomer #16	CC(C)(C)[Si](C)(C)NC(=NCCCCCCNC(=O)COC(=O)NCCCCN(CCCN)[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C	3754.2	Standard non polar	33892256
Tresperimus,3TBDMS,isomer #16	CC(C)(C)[Si](C)(C)NC(=NCCCCCCNC(=O)COC(=O)NCCCCN(CCCN)[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C	5791.5	Standard polar	33892256
Tresperimus,3TBDMS,isomer #17	CC(C)(C)[Si](C)(C)N(CCCCCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)COC(=O)NCCCCNCCCN	4392.7	Semi standard non polar	33892256
Tresperimus,3TBDMS,isomer #17	CC(C)(C)[Si](C)(C)N(CCCCCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)COC(=O)NCCCCNCCCN	3926.4	Standard non polar	33892256
Tresperimus,3TBDMS,isomer #17	CC(C)(C)[Si](C)(C)N(CCCCCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)COC(=O)NCCCCNCCCN	6226.1	Standard polar	33892256
Tresperimus,3TBDMS,isomer #18	CC(C)(C)[Si](C)(C)N(CCCCNCCCN)C(=O)OCC(=O)NCCCCCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4383.4	Semi standard non polar	33892256
Tresperimus,3TBDMS,isomer #18	CC(C)(C)[Si](C)(C)N(CCCCNCCCN)C(=O)OCC(=O)NCCCCCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3897.9	Standard non polar	33892256
Tresperimus,3TBDMS,isomer #18	CC(C)(C)[Si](C)(C)N(CCCCNCCCN)C(=O)OCC(=O)NCCCCCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	6215.2	Standard polar	33892256
Tresperimus,3TBDMS,isomer #19	CC(C)(C)[Si](C)(C)N(CCCN)CCCCNC(=O)OCC(=O)NCCCCCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4440.2	Semi standard non polar	33892256
Tresperimus,3TBDMS,isomer #19	CC(C)(C)[Si](C)(C)N(CCCN)CCCCNC(=O)OCC(=O)NCCCCCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3914.0	Standard non polar	33892256
Tresperimus,3TBDMS,isomer #19	CC(C)(C)[Si](C)(C)N(CCCN)CCCCNC(=O)OCC(=O)NCCCCCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	6267.2	Standard polar	33892256
Tresperimus,3TBDMS,isomer #2	CC(C)(C)[Si](C)(C)NC(N)=NCCCCCCNC(=O)COC(=O)NCCCCNCCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4660.0	Semi standard non polar	33892256
Tresperimus,3TBDMS,isomer #2	CC(C)(C)[Si](C)(C)NC(N)=NCCCCCCNC(=O)COC(=O)NCCCCNCCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4004.0	Standard non polar	33892256
Tresperimus,3TBDMS,isomer #2	CC(C)(C)[Si](C)(C)NC(N)=NCCCCCCNC(=O)COC(=O)NCCCCNCCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	6019.5	Standard polar	33892256
Tresperimus,3TBDMS,isomer #20	CC(C)(C)[Si](C)(C)NC(N)=NCCCCCCN(C(=O)COC(=O)N(CCCCNCCCN)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4365.4	Semi standard non polar	33892256
Tresperimus,3TBDMS,isomer #20	CC(C)(C)[Si](C)(C)NC(N)=NCCCCCCN(C(=O)COC(=O)N(CCCCNCCCN)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3816.7	Standard non polar	33892256
Tresperimus,3TBDMS,isomer #20	CC(C)(C)[Si](C)(C)NC(N)=NCCCCCCN(C(=O)COC(=O)N(CCCCNCCCN)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	6280.6	Standard polar	33892256
Tresperimus,3TBDMS,isomer #21	CC(C)(C)[Si](C)(C)NC(N)=NCCCCCCN(C(=O)COC(=O)NCCCCN(CCCN)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4412.0	Semi standard non polar	33892256
Tresperimus,3TBDMS,isomer #21	CC(C)(C)[Si](C)(C)NC(N)=NCCCCCCN(C(=O)COC(=O)NCCCCN(CCCN)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3829.9	Standard non polar	33892256
Tresperimus,3TBDMS,isomer #21	CC(C)(C)[Si](C)(C)NC(N)=NCCCCCCN(C(=O)COC(=O)NCCCCN(CCCN)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	6335.1	Standard polar	33892256
Tresperimus,3TBDMS,isomer #22	CC(C)(C)[Si](C)(C)NC(N)=NCCCCCCNC(=O)COC(=O)N(CCCCN(CCCN)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4416.6	Semi standard non polar	33892256
Tresperimus,3TBDMS,isomer #22	CC(C)(C)[Si](C)(C)NC(N)=NCCCCCCNC(=O)COC(=O)N(CCCCN(CCCN)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3808.8	Standard non polar	33892256
Tresperimus,3TBDMS,isomer #22	CC(C)(C)[Si](C)(C)NC(N)=NCCCCCCNC(=O)COC(=O)N(CCCCN(CCCN)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	6322.4	Standard polar	33892256
Tresperimus,3TBDMS,isomer #23	CC(C)(C)[Si](C)(C)N(CCCN)CCCCN(C(=O)OCC(=O)N(CCCCCCN=C(N)N)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4262.4	Semi standard non polar	33892256
Tresperimus,3TBDMS,isomer #23	CC(C)(C)[Si](C)(C)N(CCCN)CCCCN(C(=O)OCC(=O)N(CCCCCCN=C(N)N)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3846.5	Standard non polar	33892256
Tresperimus,3TBDMS,isomer #23	CC(C)(C)[Si](C)(C)N(CCCN)CCCCN(C(=O)OCC(=O)N(CCCCCCN=C(N)N)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	6544.4	Standard polar	33892256
Tresperimus,3TBDMS,isomer #3	CC(C)(C)[Si](C)(C)NCCCN(CCCCNC(=O)OCC(=O)NCCCCCCN=C(N)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4584.4	Semi standard non polar	33892256
Tresperimus,3TBDMS,isomer #3	CC(C)(C)[Si](C)(C)NCCCN(CCCCNC(=O)OCC(=O)NCCCCCCN=C(N)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3932.5	Standard non polar	33892256
Tresperimus,3TBDMS,isomer #3	CC(C)(C)[Si](C)(C)NCCCN(CCCCNC(=O)OCC(=O)NCCCCCCN=C(N)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	6047.2	Standard polar	33892256
Tresperimus,3TBDMS,isomer #4	CC(C)(C)[Si](C)(C)NCCCNCCCCN(C(=O)OCC(=O)NCCCCCCN=C(N)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4517.1	Semi standard non polar	33892256
Tresperimus,3TBDMS,isomer #4	CC(C)(C)[Si](C)(C)NCCCNCCCCN(C(=O)OCC(=O)NCCCCCCN=C(N)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3923.6	Standard non polar	33892256
Tresperimus,3TBDMS,isomer #4	CC(C)(C)[Si](C)(C)NCCCNCCCCN(C(=O)OCC(=O)NCCCCCCN=C(N)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	5971.1	Standard polar	33892256
Tresperimus,3TBDMS,isomer #5	CC(C)(C)[Si](C)(C)NCCCNCCCCNC(=O)OCC(=O)N(CCCCCCN=C(N)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4523.0	Semi standard non polar	33892256
Tresperimus,3TBDMS,isomer #5	CC(C)(C)[Si](C)(C)NCCCNCCCCNC(=O)OCC(=O)N(CCCCCCN=C(N)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3943.8	Standard non polar	33892256
Tresperimus,3TBDMS,isomer #5	CC(C)(C)[Si](C)(C)NCCCNCCCCNC(=O)OCC(=O)N(CCCCCCN=C(N)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	5985.0	Standard polar	33892256
Tresperimus,3TBDMS,isomer #6	CC(C)(C)[Si](C)(C)NCCCNCCCCNC(=O)OCC(=O)NCCCCCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4534.6	Semi standard non polar	33892256
Tresperimus,3TBDMS,isomer #6	CC(C)(C)[Si](C)(C)NCCCNCCCCNC(=O)OCC(=O)NCCCCCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4057.3	Standard non polar	33892256
Tresperimus,3TBDMS,isomer #6	CC(C)(C)[Si](C)(C)NCCCNCCCCNC(=O)OCC(=O)NCCCCCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	5877.2	Standard polar	33892256
Tresperimus,3TBDMS,isomer #7	CC(C)(C)[Si](C)(C)N(CCCCNC(=O)OCC(=O)NCCCCCCN=C(N)N)CCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4611.6	Semi standard non polar	33892256
Tresperimus,3TBDMS,isomer #7	CC(C)(C)[Si](C)(C)N(CCCCNC(=O)OCC(=O)NCCCCCCN=C(N)N)CCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3995.8	Standard non polar	33892256
Tresperimus,3TBDMS,isomer #7	CC(C)(C)[Si](C)(C)N(CCCCNC(=O)OCC(=O)NCCCCCCN=C(N)N)CCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	6302.9	Standard polar	33892256
Tresperimus,3TBDMS,isomer #8	CC(C)(C)[Si](C)(C)N(CCCCNCCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)OCC(=O)NCCCCCCN=C(N)N	4507.0	Semi standard non polar	33892256
Tresperimus,3TBDMS,isomer #8	CC(C)(C)[Si](C)(C)N(CCCCNCCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)OCC(=O)NCCCCCCN=C(N)N	3970.6	Standard non polar	33892256
Tresperimus,3TBDMS,isomer #8	CC(C)(C)[Si](C)(C)N(CCCCNCCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)OCC(=O)NCCCCCCN=C(N)N	6238.4	Standard polar	33892256
Tresperimus,3TBDMS,isomer #9	CC(C)(C)[Si](C)(C)N(CCCCCCN=C(N)N)C(=O)COC(=O)NCCCCNCCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4503.0	Semi standard non polar	33892256
Tresperimus,3TBDMS,isomer #9	CC(C)(C)[Si](C)(C)N(CCCCCCN=C(N)N)C(=O)COC(=O)NCCCCNCCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3979.1	Standard non polar	33892256
Tresperimus,3TBDMS,isomer #9	CC(C)(C)[Si](C)(C)N(CCCCCCN=C(N)N)C(=O)COC(=O)NCCCCNCCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	6252.1	Standard polar	33892256
Tresperimus,4TBDMS,isomer #1	CC(C)(C)[Si](C)(C)NC(=NCCCCCCNC(=O)COC(=O)NCCCCNCCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C	4969.4	Semi standard non polar	33892256
Tresperimus,4TBDMS,isomer #1	CC(C)(C)[Si](C)(C)NC(=NCCCCCCNC(=O)COC(=O)NCCCCNCCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C	4036.1	Standard non polar	33892256
Tresperimus,4TBDMS,isomer #1	CC(C)(C)[Si](C)(C)NC(=NCCCCCCNC(=O)COC(=O)NCCCCNCCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C	5136.2	Standard polar	33892256
Tresperimus,4TBDMS,isomer #10	CC(C)(C)[Si](C)(C)NCCCN(CCCCN(C(=O)OCC(=O)NCCCCCCN=C(N)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4694.6	Semi standard non polar	33892256
Tresperimus,4TBDMS,isomer #10	CC(C)(C)[Si](C)(C)NCCCN(CCCCN(C(=O)OCC(=O)NCCCCCCN=C(N)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3988.0	Standard non polar	33892256
Tresperimus,4TBDMS,isomer #10	CC(C)(C)[Si](C)(C)NCCCN(CCCCN(C(=O)OCC(=O)NCCCCCCN=C(N)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	5820.7	Standard polar	33892256
Tresperimus,4TBDMS,isomer #11	CC(C)(C)[Si](C)(C)NCCCN(CCCCNC(=O)OCC(=O)N(CCCCCCN=C(N)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4691.0	Semi standard non polar	33892256
Tresperimus,4TBDMS,isomer #11	CC(C)(C)[Si](C)(C)NCCCN(CCCCNC(=O)OCC(=O)N(CCCCCCN=C(N)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4005.5	Standard non polar	33892256
Tresperimus,4TBDMS,isomer #11	CC(C)(C)[Si](C)(C)NCCCN(CCCCNC(=O)OCC(=O)N(CCCCCCN=C(N)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	5840.0	Standard polar	33892256
Tresperimus,4TBDMS,isomer #12	CC(C)(C)[Si](C)(C)NCCCN(CCCCNC(=O)OCC(=O)NCCCCCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4745.3	Semi standard non polar	33892256
Tresperimus,4TBDMS,isomer #12	CC(C)(C)[Si](C)(C)NCCCN(CCCCNC(=O)OCC(=O)NCCCCCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4093.6	Standard non polar	33892256
Tresperimus,4TBDMS,isomer #12	CC(C)(C)[Si](C)(C)NCCCN(CCCCNC(=O)OCC(=O)NCCCCCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	5760.0	Standard polar	33892256
Tresperimus,4TBDMS,isomer #13	CC(C)(C)[Si](C)(C)NCCCNCCCCN(C(=O)OCC(=O)N(CCCCCCN=C(N)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4602.8	Semi standard non polar	33892256
Tresperimus,4TBDMS,isomer #13	CC(C)(C)[Si](C)(C)NCCCNCCCCN(C(=O)OCC(=O)N(CCCCCCN=C(N)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4008.2	Standard non polar	33892256
Tresperimus,4TBDMS,isomer #13	CC(C)(C)[Si](C)(C)NCCCNCCCCN(C(=O)OCC(=O)N(CCCCCCN=C(N)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	5766.4	Standard polar	33892256
Tresperimus,4TBDMS,isomer #14	CC(C)(C)[Si](C)(C)NCCCNCCCCN(C(=O)OCC(=O)NCCCCCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4651.3	Semi standard non polar	33892256
Tresperimus,4TBDMS,isomer #14	CC(C)(C)[Si](C)(C)NCCCNCCCCN(C(=O)OCC(=O)NCCCCCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4104.1	Standard non polar	33892256
Tresperimus,4TBDMS,isomer #14	CC(C)(C)[Si](C)(C)NCCCNCCCCN(C(=O)OCC(=O)NCCCCCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	5686.6	Standard polar	33892256
Tresperimus,4TBDMS,isomer #15	CC(C)(C)[Si](C)(C)NCCCNCCCCNC(=O)OCC(=O)N(CCCCCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4662.5	Semi standard non polar	33892256
Tresperimus,4TBDMS,isomer #15	CC(C)(C)[Si](C)(C)NCCCNCCCCNC(=O)OCC(=O)N(CCCCCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4125.4	Standard non polar	33892256
Tresperimus,4TBDMS,isomer #15	CC(C)(C)[Si](C)(C)NCCCNCCCCNC(=O)OCC(=O)N(CCCCCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	5706.0	Standard polar	33892256
Tresperimus,4TBDMS,isomer #16	CC(C)(C)[Si](C)(C)N(CCCCN(C(=O)OCC(=O)NCCCCCCN=C(N)N)[Si](C)(C)C(C)(C)C)CCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4733.7	Semi standard non polar	33892256
Tresperimus,4TBDMS,isomer #16	CC(C)(C)[Si](C)(C)N(CCCCN(C(=O)OCC(=O)NCCCCCCN=C(N)N)[Si](C)(C)C(C)(C)C)CCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4104.1	Standard non polar	33892256
Tresperimus,4TBDMS,isomer #16	CC(C)(C)[Si](C)(C)N(CCCCN(C(=O)OCC(=O)NCCCCCCN=C(N)N)[Si](C)(C)C(C)(C)C)CCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	6117.1	Standard polar	33892256
Tresperimus,4TBDMS,isomer #17	CC(C)(C)[Si](C)(C)N(CCCCNC(=O)OCC(=O)N(CCCCCCN=C(N)N)[Si](C)(C)C(C)(C)C)CCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4730.2	Semi standard non polar	33892256
Tresperimus,4TBDMS,isomer #17	CC(C)(C)[Si](C)(C)N(CCCCNC(=O)OCC(=O)N(CCCCCCN=C(N)N)[Si](C)(C)C(C)(C)C)CCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4113.6	Standard non polar	33892256
Tresperimus,4TBDMS,isomer #17	CC(C)(C)[Si](C)(C)N(CCCCNC(=O)OCC(=O)N(CCCCCCN=C(N)N)[Si](C)(C)C(C)(C)C)CCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	6133.3	Standard polar	33892256
Tresperimus,4TBDMS,isomer #18	CC(C)(C)[Si](C)(C)N(CCCCCCN=C(N)N)C(=O)COC(=O)N(CCCCNCCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4608.6	Semi standard non polar	33892256
Tresperimus,4TBDMS,isomer #18	CC(C)(C)[Si](C)(C)N(CCCCCCN=C(N)N)C(=O)COC(=O)N(CCCCNCCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4097.4	Standard non polar	33892256
Tresperimus,4TBDMS,isomer #18	CC(C)(C)[Si](C)(C)N(CCCCCCN=C(N)N)C(=O)COC(=O)N(CCCCNCCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	6073.0	Standard polar	33892256
Tresperimus,4TBDMS,isomer #19	CC(C)(C)[Si](C)(C)NCCCN(CCCCN(C(=O)OCC(=O)N(CCCCCCN=C(N)N)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4549.8	Semi standard non polar	33892256
Tresperimus,4TBDMS,isomer #19	CC(C)(C)[Si](C)(C)NCCCN(CCCCN(C(=O)OCC(=O)N(CCCCCCN=C(N)N)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4043.0	Standard non polar	33892256
Tresperimus,4TBDMS,isomer #19	CC(C)(C)[Si](C)(C)NCCCN(CCCCN(C(=O)OCC(=O)N(CCCCCCN=C(N)N)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	6091.3	Standard polar	33892256
Tresperimus,4TBDMS,isomer #2	CC(C)(C)[Si](C)(C)NCCCN(CCCCNC(=O)OCC(=O)NCCCCCCN=C(N[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4889.3	Semi standard non polar	33892256
Tresperimus,4TBDMS,isomer #2	CC(C)(C)[Si](C)(C)NCCCN(CCCCNC(=O)OCC(=O)NCCCCCCN=C(N[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3917.0	Standard non polar	33892256
Tresperimus,4TBDMS,isomer #2	CC(C)(C)[Si](C)(C)NCCCN(CCCCNC(=O)OCC(=O)NCCCCCCN=C(N[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	5176.8	Standard polar	33892256
Tresperimus,4TBDMS,isomer #20	CC(C)(C)[Si](C)(C)N(C(=NCCCCCCNC(=O)COC(=O)NCCCCNCCCN)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4639.1	Semi standard non polar	33892256
Tresperimus,4TBDMS,isomer #20	CC(C)(C)[Si](C)(C)N(C(=NCCCCCCNC(=O)COC(=O)NCCCCNCCCN)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4167.1	Standard non polar	33892256
Tresperimus,4TBDMS,isomer #20	CC(C)(C)[Si](C)(C)N(C(=NCCCCCCNC(=O)COC(=O)NCCCCNCCCN)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	5136.9	Standard polar	33892256
Tresperimus,4TBDMS,isomer #21	CC(C)(C)[Si](C)(C)NC(=NCCCCCCN(C(=O)COC(=O)NCCCCNCCCN)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4639.4	Semi standard non polar	33892256
Tresperimus,4TBDMS,isomer #21	CC(C)(C)[Si](C)(C)NC(=NCCCCCCN(C(=O)COC(=O)NCCCCNCCCN)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4036.1	Standard non polar	33892256
Tresperimus,4TBDMS,isomer #21	CC(C)(C)[Si](C)(C)NC(=NCCCCCCN(C(=O)COC(=O)NCCCCNCCCN)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	5303.7	Standard polar	33892256
Tresperimus,4TBDMS,isomer #22	CC(C)(C)[Si](C)(C)NC(=NCCCCCCNC(=O)COC(=O)N(CCCCNCCCN)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4614.9	Semi standard non polar	33892256
Tresperimus,4TBDMS,isomer #22	CC(C)(C)[Si](C)(C)NC(=NCCCCCCNC(=O)COC(=O)N(CCCCNCCCN)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4013.9	Standard non polar	33892256
Tresperimus,4TBDMS,isomer #22	CC(C)(C)[Si](C)(C)NC(=NCCCCCCNC(=O)COC(=O)N(CCCCNCCCN)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	5281.1	Standard polar	33892256
Tresperimus,4TBDMS,isomer #23	CC(C)(C)[Si](C)(C)NC(=NCCCCCCNC(=O)COC(=O)NCCCCN(CCCN)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4683.6	Semi standard non polar	33892256
Tresperimus,4TBDMS,isomer #23	CC(C)(C)[Si](C)(C)NC(=NCCCCCCNC(=O)COC(=O)NCCCCN(CCCN)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4004.8	Standard non polar	33892256
Tresperimus,4TBDMS,isomer #23	CC(C)(C)[Si](C)(C)NC(=NCCCCCCNC(=O)COC(=O)NCCCCN(CCCN)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	5352.1	Standard polar	33892256
Tresperimus,4TBDMS,isomer #24	CC(C)(C)[Si](C)(C)NC(=NCCCCCCN(C(=O)COC(=O)N(CCCCNCCCN)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C	4630.2	Semi standard non polar	33892256
Tresperimus,4TBDMS,isomer #24	CC(C)(C)[Si](C)(C)NC(=NCCCCCCN(C(=O)COC(=O)N(CCCCNCCCN)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C	3841.7	Standard non polar	33892256
Tresperimus,4TBDMS,isomer #24	CC(C)(C)[Si](C)(C)NC(=NCCCCCCN(C(=O)COC(=O)N(CCCCNCCCN)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C	5446.6	Standard polar	33892256
Tresperimus,4TBDMS,isomer #25	CC(C)(C)[Si](C)(C)NC(=NCCCCCCN(C(=O)COC(=O)NCCCCN(CCCN)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C	4693.2	Semi standard non polar	33892256
Tresperimus,4TBDMS,isomer #25	CC(C)(C)[Si](C)(C)NC(=NCCCCCCN(C(=O)COC(=O)NCCCCN(CCCN)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C	3841.7	Standard non polar	33892256
Tresperimus,4TBDMS,isomer #25	CC(C)(C)[Si](C)(C)NC(=NCCCCCCN(C(=O)COC(=O)NCCCCN(CCCN)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C	5518.1	Standard polar	33892256
Tresperimus,4TBDMS,isomer #26	CC(C)(C)[Si](C)(C)NC(=NCCCCCCNC(=O)COC(=O)N(CCCCN(CCCN)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C	4692.3	Semi standard non polar	33892256
Tresperimus,4TBDMS,isomer #26	CC(C)(C)[Si](C)(C)NC(=NCCCCCCNC(=O)COC(=O)N(CCCCN(CCCN)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C	3821.4	Standard non polar	33892256
Tresperimus,4TBDMS,isomer #26	CC(C)(C)[Si](C)(C)NC(=NCCCCCCNC(=O)COC(=O)N(CCCCN(CCCN)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C	5495.4	Standard polar	33892256
Tresperimus,4TBDMS,isomer #27	CC(C)(C)[Si](C)(C)N(CCCCCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)COC(=O)N(CCCCNCCCN)[Si](C)(C)C(C)(C)C	4500.0	Semi standard non polar	33892256
Tresperimus,4TBDMS,isomer #27	CC(C)(C)[Si](C)(C)N(CCCCCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)COC(=O)N(CCCCNCCCN)[Si](C)(C)C(C)(C)C	4007.3	Standard non polar	33892256
Tresperimus,4TBDMS,isomer #27	CC(C)(C)[Si](C)(C)N(CCCCCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)COC(=O)N(CCCCNCCCN)[Si](C)(C)C(C)(C)C	6067.2	Standard polar	33892256
Tresperimus,4TBDMS,isomer #28	CC(C)(C)[Si](C)(C)N(CCCN)CCCCNC(=O)OCC(=O)N(CCCCCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4564.3	Semi standard non polar	33892256
Tresperimus,4TBDMS,isomer #28	CC(C)(C)[Si](C)(C)N(CCCN)CCCCNC(=O)OCC(=O)N(CCCCCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4017.3	Standard non polar	33892256
Tresperimus,4TBDMS,isomer #28	CC(C)(C)[Si](C)(C)N(CCCN)CCCCNC(=O)OCC(=O)N(CCCCCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	6121.9	Standard polar	33892256
Tresperimus,4TBDMS,isomer #29	CC(C)(C)[Si](C)(C)N(CCCN)CCCCN(C(=O)OCC(=O)NCCCCCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4556.7	Semi standard non polar	33892256
Tresperimus,4TBDMS,isomer #29	CC(C)(C)[Si](C)(C)N(CCCN)CCCCN(C(=O)OCC(=O)NCCCCCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3996.3	Standard non polar	33892256
Tresperimus,4TBDMS,isomer #29	CC(C)(C)[Si](C)(C)N(CCCN)CCCCN(C(=O)OCC(=O)NCCCCCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	6106.8	Standard polar	33892256
Tresperimus,4TBDMS,isomer #3	CC(C)(C)[Si](C)(C)NCCCNCCCCN(C(=O)OCC(=O)NCCCCCCN=C(N[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4806.0	Semi standard non polar	33892256
Tresperimus,4TBDMS,isomer #3	CC(C)(C)[Si](C)(C)NCCCNCCCCN(C(=O)OCC(=O)NCCCCCCN=C(N[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3941.7	Standard non polar	33892256
Tresperimus,4TBDMS,isomer #3	CC(C)(C)[Si](C)(C)NCCCNCCCCN(C(=O)OCC(=O)NCCCCCCN=C(N[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	5075.2	Standard polar	33892256
Tresperimus,4TBDMS,isomer #30	CC(C)(C)[Si](C)(C)NC(N)=NCCCCCCN(C(=O)COC(=O)N(CCCCN(CCCN)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4525.9	Semi standard non polar	33892256
Tresperimus,4TBDMS,isomer #30	CC(C)(C)[Si](C)(C)NC(N)=NCCCCCCN(C(=O)COC(=O)N(CCCCN(CCCN)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3930.7	Standard non polar	33892256
Tresperimus,4TBDMS,isomer #30	CC(C)(C)[Si](C)(C)NC(N)=NCCCCCCN(C(=O)COC(=O)N(CCCCN(CCCN)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	6156.0	Standard polar	33892256
Tresperimus,4TBDMS,isomer #4	CC(C)(C)[Si](C)(C)NCCCNCCCCNC(=O)OCC(=O)N(CCCCCCN=C(N[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4814.2	Semi standard non polar	33892256
Tresperimus,4TBDMS,isomer #4	CC(C)(C)[Si](C)(C)NCCCNCCCCNC(=O)OCC(=O)N(CCCCCCN=C(N[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3961.0	Standard non polar	33892256
Tresperimus,4TBDMS,isomer #4	CC(C)(C)[Si](C)(C)NCCCNCCCCNC(=O)OCC(=O)N(CCCCCCN=C(N[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	5099.1	Standard polar	33892256
Tresperimus,4TBDMS,isomer #5	CC(C)(C)[Si](C)(C)NCCCNCCCCNC(=O)OCC(=O)NCCCCCCN=C(N[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4794.7	Semi standard non polar	33892256
Tresperimus,4TBDMS,isomer #5	CC(C)(C)[Si](C)(C)NCCCNCCCCNC(=O)OCC(=O)NCCCCCCN=C(N[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4191.0	Standard non polar	33892256
Tresperimus,4TBDMS,isomer #5	CC(C)(C)[Si](C)(C)NCCCNCCCCNC(=O)OCC(=O)NCCCCCCN=C(N[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4884.9	Standard polar	33892256
Tresperimus,4TBDMS,isomer #6	CC(C)(C)[Si](C)(C)N(CCCNCCCCNC(=O)OCC(=O)NCCCCCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4817.8	Semi standard non polar	33892256
Tresperimus,4TBDMS,isomer #6	CC(C)(C)[Si](C)(C)N(CCCNCCCCNC(=O)OCC(=O)NCCCCCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4183.0	Standard non polar	33892256
Tresperimus,4TBDMS,isomer #6	CC(C)(C)[Si](C)(C)N(CCCNCCCCNC(=O)OCC(=O)NCCCCCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	5729.4	Standard polar	33892256
Tresperimus,4TBDMS,isomer #7	CC(C)(C)[Si](C)(C)NC(N)=NCCCCCCN(C(=O)COC(=O)NCCCCNCCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4771.8	Semi standard non polar	33892256
Tresperimus,4TBDMS,isomer #7	CC(C)(C)[Si](C)(C)NC(N)=NCCCCCCN(C(=O)COC(=O)NCCCCNCCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4082.9	Standard non polar	33892256
Tresperimus,4TBDMS,isomer #7	CC(C)(C)[Si](C)(C)NC(N)=NCCCCCCN(C(=O)COC(=O)NCCCCNCCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	5810.5	Standard polar	33892256
Tresperimus,4TBDMS,isomer #8	CC(C)(C)[Si](C)(C)NC(N)=NCCCCCCNC(=O)COC(=O)N(CCCCNCCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4761.9	Semi standard non polar	33892256
Tresperimus,4TBDMS,isomer #8	CC(C)(C)[Si](C)(C)NC(N)=NCCCCCCNC(=O)COC(=O)N(CCCCNCCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4067.7	Standard non polar	33892256
Tresperimus,4TBDMS,isomer #8	CC(C)(C)[Si](C)(C)NC(N)=NCCCCCCNC(=O)COC(=O)N(CCCCNCCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	5791.8	Standard polar	33892256
Tresperimus,4TBDMS,isomer #9	CC(C)(C)[Si](C)(C)NC(N)=NCCCCCCNC(=O)COC(=O)NCCCCN(CCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4876.3	Semi standard non polar	33892256
Tresperimus,4TBDMS,isomer #9	CC(C)(C)[Si](C)(C)NC(N)=NCCCCCCNC(=O)COC(=O)NCCCCN(CCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4066.6	Standard non polar	33892256
Tresperimus,4TBDMS,isomer #9	CC(C)(C)[Si](C)(C)NC(N)=NCCCCCCNC(=O)COC(=O)NCCCCN(CCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	5863.0	Standard polar	33892256

Spectra

GC-MS Spectra

Spectrum Type	Description	Splash Key	Deposition Date	Source	View
Predicted GC-MS	Predicted GC-MS Spectrum - Tresperimus GC-MS (Non-derivatized) - 70eV, Positive	splash10-001r-9841000000-c26e8e04c77f5e61a38d	2021-09-23	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Tresperimus GC-MS (Non-derivatized) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum

Biological Properties

Cellular Locations

Not Available

Biospecimen Locations

Blood

Tissue Locations

Not Available

Pathways

Not Available

Name	SMPDB/PathBank	KEGG

Normal Concentrations

Biospecimen	Status	Value	Age	Sex	Condition	Reference	Details
Blood	Detected but not Quantified	Not Quantified	Not Specified	Not Specified	Normal	31557052	details

Abnormal Concentrations

Not Available

Associated Disorders and Diseases

Disease References

None

Associated OMIM IDs

None

External Links

DrugBank ID

Not Available

Phenol Explorer Compound ID

Not Available

FooDB ID

Not Available

KNApSAcK ID

Not Available

Chemspider ID

2343245

KEGG Compound ID

Not Available

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Not Available

METLIN ID

Not Available

PubChem Compound

3086680

PDB ID

Not Available

ChEBI ID

Not Available

Food Biomarker Ontology

Not Available

VMH ID

Not Available

MarkerDB ID

Not Available

Good Scents ID

Not Available

References

Synthesis Reference

Not Available

Material Safety Data Sheet (MSDS)

Not Available

General References

Barupal DK, Fiehn O: Generating the Blood Exposome Database Using a Comprehensive Text Mining and Database Fusion Approach. Environ Health Perspect. 2019 Sep;127(9):97008. doi: 10.1289/EHP4713. Epub 2019 Sep 26. [PubMed:31557052 ]

Showing metabocard for Tresperimus (HMDB0259122)

MOL for HMDB0259122 (Tresperimus)

3D MOL for HMDB0259122 (Tresperimus)

3D SDF for HMDB0259122 (Tresperimus)

3D-SDF for HMDB0259122 (Tresperimus)

PDB for HMDB0259122 (Tresperimus)

3D PDB for HMDB0259122 (Tresperimus)

SMILES for HMDB0259122 (Tresperimus)

INCHI for HMDB0259122 (Tresperimus)

Structure for HMDB0259122 (Tresperimus)

3D Structure for HMDB0259122 (Tresperimus)

Predicted Collision Cross Sections

Predicted Kovats Retention Indices

Underivatized

Derivatized

GC-MS Spectra