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Record Information

Version

5.0

Status

Detected but not Quantified

Creation Date

2021-09-11 03:45:36 UTC

Update Date

2021-09-26 22:59:59 UTC

HMDB ID

HMDB0249255

Secondary Accession Numbers

None

Metabolite Identification

Common Name

Bis(agmatine)oxalamide

Description

N,N'-bis(4-carbamimidamidobutyl)ethanediamide belongs to the class of organic compounds known as alpha amino acid amides. These are amide derivatives of alpha amino acids. Based on a literature review very few articles have been published on N,N'-bis(4-carbamimidamidobutyl)ethanediamide. This compound has been identified in human blood as reported by (PMID: 31557052 ). Bis(agmatine)oxalamide is not a naturally occurring metabolite and is only found in those individuals exposed to this compound or its derivatives. Technically Bis(agmatine)oxalamide 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

HMDB0249255
     RDKit          3D
Bis(agmatine)oxalamide
 48 47  0  0  0  0  0  0  0  0999 V2000
   -4.9357    1.6456   -0.0915 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6068    1.7729    1.2833 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1938    2.8021    2.0579 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7774    0.9601    1.8374 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1757   -0.1145    0.9933 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1383   -1.2546    0.9968 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7968   -2.4520    0.1856 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5559   -3.1340    0.6064 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3877   -2.3202    0.4847 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9851   -1.7818   -0.7610 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6151   -1.9810   -1.8290 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2100   -0.9607   -0.8144 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8847   -0.7235    0.2182 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6213   -0.4172   -2.0567 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.8151    0.4120   -2.1543 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0567   -0.3098   -1.7243 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2373    0.5909   -1.8492 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1251    1.8290   -1.0076 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0051    1.3878    0.3820 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.0304    1.1845    1.1156 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3268    1.3818    0.6017 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.8613    0.7599    2.4485 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2723    1.8544   -0.8645 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8931    1.3258   -0.3429 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7565    3.2522    2.8741 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1597    3.1534    1.7955 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1747   -0.3303    1.4077 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0284    0.3395   -0.0030 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2869   -1.5237    2.0863 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1407   -0.8281    0.7156 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7089   -2.1204   -0.8998 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6729   -3.1690    0.2137 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7118   -3.4802    1.6670 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3804   -4.0931    0.0138 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7927   -2.1309    1.3348 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0939   -0.5841   -2.9487 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9801    0.7674   -3.1896 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6020    1.3094   -1.5356 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0200   -0.7397   -0.7203 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2029   -1.1568   -2.4331 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1505    0.0506   -1.5149 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4335    0.8733   -2.9219 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2556    2.4559   -1.2234 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0232    2.4678   -1.1448 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.7832    2.3155    0.6626 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.8380    0.5893    0.1557 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4455    1.4108    3.1426 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1450   -0.1925    2.7496 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  2  4  2  3
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  9 10  1  0
 10 11  2  0
 10 12  1  0
 12 13  2  0
 12 14  1  0
 14 15  1  0
 15 16  1  0
 16 17  1  0
 17 18  1  0
 18 19  1  0
 19 20  2  3
 20 21  1  0
 20 22  1  0
  1 23  1  0
  1 24  1  0
  3 25  1  0
  3 26  1  0
  5 27  1  0
  5 28  1  0
  6 29  1  0
  6 30  1  0
  7 31  1  0
  7 32  1  0
  8 33  1  0
  8 34  1  0
  9 35  1  0
 14 36  1  0
 15 37  1  0
 15 38  1  0
 16 39  1  0
 16 40  1  0
 17 41  1  0
 17 42  1  0
 18 43  1  0
 18 44  1  0
 21 45  1  0
 21 46  1  0
 22 47  1  0
 22 48  1  0
M  END


  Mrv1652309112105452D          

 22 21  0  0  0  0            999 V2000
    6.9020    3.9849    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1875    3.5724    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4730    3.9849    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7586    3.5724    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.0441    3.9849    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3296    3.5724    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.0441    4.8099    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.6164    3.5724    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3309    3.9849    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.0454    3.5724    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0454    2.7474    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.7599    3.9849    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7599    4.8099    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.4743    3.5724    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.1888    3.9849    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9033    3.5724    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6177    3.9849    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3322    3.5724    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0467    3.9849    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   14.7612    3.5724    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.4756    3.9849    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   14.7612    2.7474    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  2  0  0  0  0
  5  6  1  0  0  0  0
  5  7  1  0  0  0  0
  1  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  2  0  0  0  0
 10 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  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  2  0  0  0  0
 20 21  1  0  0  0  0
 20 22  1  0  0  0  0
M  END
> <DATABASE_ID>
HMDB0249255

> <DATABASE_NAME>
hmdb

> <SMILES>
NC(N)=NCCCCNC(=O)C(=O)NCCCCN=C(N)N

> <INCHI_IDENTIFIER>
InChI=1S/C12H26N8O2/c13-11(14)19-7-3-1-5-17-9(21)10(22)18-6-2-4-8-20-12(15)16/h1-8H2,(H,17,21)(H,18,22)(H4,13,14,19)(H4,15,16,20)

> <INCHI_KEY>
LJNNDZUYUVWDBY-UHFFFAOYSA-N

> <FORMULA>
C12H26N8O2

> <MOLECULAR_WEIGHT>
314.394

> <EXACT_MASS>
314.217872109

> <JCHEM_ACCEPTOR_COUNT>
8

> <JCHEM_ATOM_COUNT>
48

> <JCHEM_AVERAGE_POLARIZABILITY>
34.89051867030821

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
6

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
N,N'-bis({4-[(diaminomethylidene)amino]butyl})ethanediamide

> <ALOGPS_LOGP>
-1.59

> <JCHEM_LOGP>
-2.645015630666666

> <ALOGPS_LOGS>
-3.42

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
2

> <JCHEM_PKA>
17.949602907293393

> <JCHEM_PKA_STRONGEST_ACIDIC>
13.0937951854137

> <JCHEM_PKA_STRONGEST_BASIC>
11.655138470335402

> <JCHEM_POLAR_SURFACE_AREA>
187.0

> <JCHEM_REFRACTIVITY>
83.63960000000002

> <JCHEM_ROTATABLE_BOND_COUNT>
11

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
1.19e-01 g/l

> <JCHEM_TRADITIONAL_IUPAC>
N,N'-bis({4-[(diaminomethylidene)amino]butyl})ethanediamide

> <JCHEM_VEBER_RULE>
0

$$$$

HMDB0249255
     RDKit          3D
Bis(agmatine)oxalamide
 48 47  0  0  0  0  0  0  0  0999 V2000
   -4.9357    1.6456   -0.0915 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6068    1.7729    1.2833 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1938    2.8021    2.0579 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7774    0.9601    1.8374 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1757   -0.1145    0.9933 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1383   -1.2546    0.9968 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7968   -2.4520    0.1856 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5559   -3.1340    0.6064 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3877   -2.3202    0.4847 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9851   -1.7818   -0.7610 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6151   -1.9810   -1.8290 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2100   -0.9607   -0.8144 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8847   -0.7235    0.2182 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6213   -0.4172   -2.0567 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.8151    0.4120   -2.1543 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0567   -0.3098   -1.7243 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2373    0.5909   -1.8492 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1251    1.8290   -1.0076 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0051    1.3878    0.3820 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.0304    1.1845    1.1156 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3268    1.3818    0.6017 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.8613    0.7599    2.4485 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2723    1.8544   -0.8645 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8931    1.3258   -0.3429 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7565    3.2522    2.8741 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1597    3.1534    1.7955 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1747   -0.3303    1.4077 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0284    0.3395   -0.0030 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2869   -1.5237    2.0863 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1407   -0.8281    0.7156 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7089   -2.1204   -0.8998 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6729   -3.1690    0.2137 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7118   -3.4802    1.6670 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3804   -4.0931    0.0138 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7927   -2.1309    1.3348 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0939   -0.5841   -2.9487 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9801    0.7674   -3.1896 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6020    1.3094   -1.5356 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0200   -0.7397   -0.7203 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2029   -1.1568   -2.4331 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1505    0.0506   -1.5149 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4335    0.8733   -2.9219 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2556    2.4559   -1.2234 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0232    2.4678   -1.1448 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.7832    2.3155    0.6626 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.8380    0.5893    0.1557 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4455    1.4108    3.1426 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1450   -0.1925    2.7496 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  2  4  2  3
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  9 10  1  0
 10 11  2  0
 10 12  1  0
 12 13  2  0
 12 14  1  0
 14 15  1  0
 15 16  1  0
 16 17  1  0
 17 18  1  0
 18 19  1  0
 19 20  2  3
 20 21  1  0
 20 22  1  0
  1 23  1  0
  1 24  1  0
  3 25  1  0
  3 26  1  0
  5 27  1  0
  5 28  1  0
  6 29  1  0
  6 30  1  0
  7 31  1  0
  7 32  1  0
  8 33  1  0
  8 34  1  0
  9 35  1  0
 14 36  1  0
 15 37  1  0
 15 38  1  0
 16 39  1  0
 16 40  1  0
 17 41  1  0
 17 42  1  0
 18 43  1  0
 18 44  1  0
 21 45  1  0
 21 46  1  0
 22 47  1  0
 22 48  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      12.884   7.438   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0      11.550   6.668   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0      10.216   7.438   0.000  0.00  0.00           C+0
HETATM    4  N   UNK     0       8.883   6.668   0.000  0.00  0.00           N+0
HETATM    5  C   UNK     0       7.549   7.438   0.000  0.00  0.00           C+0
HETATM    6  N   UNK     0       6.215   6.668   0.000  0.00  0.00           N+0
HETATM    7  N   UNK     0       7.549   8.978   0.000  0.00  0.00           N+0
HETATM    8  C   UNK     0      14.217   6.668   0.000  0.00  0.00           C+0
HETATM    9  N   UNK     0      15.551   7.438   0.000  0.00  0.00           N+0
HETATM   10  C   UNK     0      16.885   6.668   0.000  0.00  0.00           C+0
HETATM   11  O   UNK     0      16.885   5.128   0.000  0.00  0.00           O+0
HETATM   12  C   UNK     0      18.218   7.438   0.000  0.00  0.00           C+0
HETATM   13  O   UNK     0      18.218   8.978   0.000  0.00  0.00           O+0
HETATM   14  N   UNK     0      19.552   6.668   0.000  0.00  0.00           N+0
HETATM   15  C   UNK     0      20.886   7.438   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0      22.219   6.668   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0      23.553   7.438   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0      24.887   6.668   0.000  0.00  0.00           C+0
HETATM   19  N   UNK     0      26.220   7.438   0.000  0.00  0.00           N+0
HETATM   20  C   UNK     0      27.554   6.668   0.000  0.00  0.00           C+0
HETATM   21  N   UNK     0      28.888   7.438   0.000  0.00  0.00           N+0
HETATM   22  N   UNK     0      27.554   5.128   0.000  0.00  0.00           N+0
CONECT    1    2    8                                                       
CONECT    2    1    3                                                       
CONECT    3    2    4                                                       
CONECT    4    3    5                                                       
CONECT    5    4    6    7                                                  
CONECT    6    5                                                            
CONECT    7    5                                                            
CONECT    8    1    9                                                       
CONECT    9    8   10                                                       
CONECT   10    9   11   12                                                  
CONECT   11   10                                                            
CONECT   12   10   13   14                                                  
CONECT   13   12                                                            
CONECT   14   12   15                                                       
CONECT   15   14   16                                                       
CONECT   16   15   17                                                       
CONECT   17   16   18                                                       
CONECT   18   17   19                                                       
CONECT   19   18   20                                                       
CONECT   20   19   21   22                                                  
CONECT   21   20                                                            
CONECT   22   20                                                            
MASTER        0    0    0    0    0    0    0    0   22    0   42    0
END

COMPND    HMDB0249255
HETATM    1  N1  UNL     1      -4.936   1.646  -0.092  1.00  0.00           N  
HETATM    2  C1  UNL     1      -4.607   1.773   1.283  1.00  0.00           C  
HETATM    3  N2  UNL     1      -5.194   2.802   2.058  1.00  0.00           N  
HETATM    4  N3  UNL     1      -3.777   0.960   1.837  1.00  0.00           N  
HETATM    5  C2  UNL     1      -3.176  -0.114   0.993  1.00  0.00           C  
HETATM    6  C3  UNL     1      -4.138  -1.255   0.997  1.00  0.00           C  
HETATM    7  C4  UNL     1      -3.797  -2.452   0.186  1.00  0.00           C  
HETATM    8  C5  UNL     1      -2.556  -3.134   0.606  1.00  0.00           C  
HETATM    9  N4  UNL     1      -1.388  -2.320   0.485  1.00  0.00           N  
HETATM   10  C6  UNL     1      -0.985  -1.782  -0.761  1.00  0.00           C  
HETATM   11  O1  UNL     1      -1.615  -1.981  -1.829  1.00  0.00           O  
HETATM   12  C7  UNL     1       0.210  -0.961  -0.814  1.00  0.00           C  
HETATM   13  O2  UNL     1       0.885  -0.724   0.218  1.00  0.00           O  
HETATM   14  N5  UNL     1       0.621  -0.417  -2.057  1.00  0.00           N  
HETATM   15  C8  UNL     1       1.815   0.412  -2.154  1.00  0.00           C  
HETATM   16  C9  UNL     1       3.057  -0.310  -1.724  1.00  0.00           C  
HETATM   17  C10 UNL     1       4.237   0.591  -1.849  1.00  0.00           C  
HETATM   18  C11 UNL     1       4.125   1.829  -1.008  1.00  0.00           C  
HETATM   19  N6  UNL     1       4.005   1.388   0.382  1.00  0.00           N  
HETATM   20  C12 UNL     1       5.030   1.185   1.116  1.00  0.00           C  
HETATM   21  N7  UNL     1       6.327   1.382   0.602  1.00  0.00           N  
HETATM   22  N8  UNL     1       4.861   0.760   2.448  1.00  0.00           N  
HETATM   23  H1  UNL     1      -4.272   1.854  -0.864  1.00  0.00           H  
HETATM   24  H2  UNL     1      -5.893   1.326  -0.343  1.00  0.00           H  
HETATM   25  H3  UNL     1      -4.756   3.252   2.874  1.00  0.00           H  
HETATM   26  H4  UNL     1      -6.160   3.153   1.796  1.00  0.00           H  
HETATM   27  H5  UNL     1      -2.175  -0.330   1.408  1.00  0.00           H  
HETATM   28  H6  UNL     1      -3.028   0.339  -0.003  1.00  0.00           H  
HETATM   29  H7  UNL     1      -4.287  -1.524   2.086  1.00  0.00           H  
HETATM   30  H8  UNL     1      -5.141  -0.828   0.716  1.00  0.00           H  
HETATM   31  H9  UNL     1      -3.709  -2.120  -0.900  1.00  0.00           H  
HETATM   32  H10 UNL     1      -4.673  -3.169   0.214  1.00  0.00           H  
HETATM   33  H11 UNL     1      -2.712  -3.480   1.667  1.00  0.00           H  
HETATM   34  H12 UNL     1      -2.380  -4.093   0.014  1.00  0.00           H  
HETATM   35  H13 UNL     1      -0.793  -2.131   1.335  1.00  0.00           H  
HETATM   36  H14 UNL     1       0.094  -0.584  -2.949  1.00  0.00           H  
HETATM   37  H15 UNL     1       1.980   0.767  -3.190  1.00  0.00           H  
HETATM   38  H16 UNL     1       1.602   1.309  -1.536  1.00  0.00           H  
HETATM   39  H17 UNL     1       3.020  -0.740  -0.720  1.00  0.00           H  
HETATM   40  H18 UNL     1       3.203  -1.157  -2.433  1.00  0.00           H  
HETATM   41  H19 UNL     1       5.151   0.051  -1.515  1.00  0.00           H  
HETATM   42  H20 UNL     1       4.434   0.873  -2.922  1.00  0.00           H  
HETATM   43  H21 UNL     1       3.256   2.456  -1.223  1.00  0.00           H  
HETATM   44  H22 UNL     1       5.023   2.468  -1.145  1.00  0.00           H  
HETATM   45  H23 UNL     1       6.783   2.315   0.663  1.00  0.00           H  
HETATM   46  H24 UNL     1       6.838   0.589   0.156  1.00  0.00           H  
HETATM   47  H25 UNL     1       4.446   1.411   3.143  1.00  0.00           H  
HETATM   48  H26 UNL     1       5.145  -0.192   2.750  1.00  0.00           H  
CONECT    1    2   23   24
CONECT    2    3    4    4
CONECT    3   25   26
CONECT    4    5
CONECT    5    6   27   28
CONECT    6    7   29   30
CONECT    7    8   31   32
CONECT    8    9   33   34
CONECT    9   10   35
CONECT   10   11   11   12
CONECT   12   13   13   14
CONECT   14   15   36
CONECT   15   16   37   38
CONECT   16   17   39   40
CONECT   17   18   41   42
CONECT   18   19   43   44
CONECT   19   20   20
CONECT   20   21   22
CONECT   21   45   46
CONECT   22   47   48
END

HMDB0249255
     RDKit          3D
Bis(agmatine)oxalamide
 48 47  0  0  0  0  0  0  0  0999 V2000
   -4.9357    1.6456   -0.0915 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6068    1.7729    1.2833 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1938    2.8021    2.0579 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7774    0.9601    1.8374 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1757   -0.1145    0.9933 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1383   -1.2546    0.9968 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7968   -2.4520    0.1856 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5559   -3.1340    0.6064 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3877   -2.3202    0.4847 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9851   -1.7818   -0.7610 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6151   -1.9810   -1.8290 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2100   -0.9607   -0.8144 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8847   -0.7235    0.2182 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6213   -0.4172   -2.0567 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.8151    0.4120   -2.1543 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0567   -0.3098   -1.7243 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2373    0.5909   -1.8492 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1251    1.8290   -1.0076 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0051    1.3878    0.3820 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.0304    1.1845    1.1156 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3268    1.3818    0.6017 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.8613    0.7599    2.4485 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2723    1.8544   -0.8645 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8931    1.3258   -0.3429 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7565    3.2522    2.8741 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1597    3.1534    1.7955 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1747   -0.3303    1.4077 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0284    0.3395   -0.0030 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2869   -1.5237    2.0863 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1407   -0.8281    0.7156 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7089   -2.1204   -0.8998 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6729   -3.1690    0.2137 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7118   -3.4802    1.6670 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3804   -4.0931    0.0138 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7927   -2.1309    1.3348 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0939   -0.5841   -2.9487 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9801    0.7674   -3.1896 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6020    1.3094   -1.5356 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0200   -0.7397   -0.7203 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2029   -1.1568   -2.4331 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1505    0.0506   -1.5149 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4335    0.8733   -2.9219 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2556    2.4559   -1.2234 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0232    2.4678   -1.1448 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.7832    2.3155    0.6626 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.8380    0.5893    0.1557 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4455    1.4108    3.1426 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1450   -0.1925    2.7496 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  2  4  2  3
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  9 10  1  0
 10 11  2  0
 10 12  1  0
 12 13  2  0
 12 14  1  0
 14 15  1  0
 15 16  1  0
 16 17  1  0
 17 18  1  0
 18 19  1  0
 19 20  2  3
 20 21  1  0
 20 22  1  0
  1 23  1  0
  1 24  1  0
  3 25  1  0
  3 26  1  0
  5 27  1  0
  5 28  1  0
  6 29  1  0
  6 30  1  0
  7 31  1  0
  7 32  1  0
  8 33  1  0
  8 34  1  0
  9 35  1  0
 14 36  1  0
 15 37  1  0
 15 38  1  0
 16 39  1  0
 16 40  1  0
 17 41  1  0
 17 42  1  0
 18 43  1  0
 18 44  1  0
 21 45  1  0
 21 46  1  0
 22 47  1  0
 22 48  1  0
M  END

View in JSmol View NMR Assignments View Stereo Labels

Synonyms

Value	Source
PLT-I	MeSH
N,N'-bis(4-guanidinobutyl)oxalamide	MeSH

Chemical Formula

C₁₂H₂₆N₈O₂

Average Molecular Weight

314.394

Monoisotopic Molecular Weight

314.217872109

IUPAC Name

N,N'-bis({4-[(diaminomethylidene)amino]butyl})ethanediamide

Traditional Name

N,N'-bis({4-[(diaminomethylidene)amino]butyl})ethanediamide

CAS Registry Number

Not Available

SMILES

NC(N)=NCCCCNC(=O)C(=O)NCCCCN=C(N)N

InChI Identifier

InChI=1S/C12H26N8O2/c13-11(14)19-7-3-1-5-17-9(21)10(22)18-6-2-4-8-20-12(15)16/h1-8H2,(H,17,21)(H,18,22)(H4,13,14,19)(H4,15,16,20)

InChI Key

LJNNDZUYUVWDBY-UHFFFAOYSA-N

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as alpha amino acid amides. These are amide derivatives of alpha amino acids.

Kingdom

Organic compounds

Super Class

Organic acids and derivatives

Class

Carboxylic acids and derivatives

Sub Class

Amino acids, peptides, and analogues

Direct Parent

Alpha amino acid amides

Alternative Parents

Substituents

Alpha-amino acid amide
Secondary carboxylic acid amide
Guanidine
Carboxamide group
Organic 1,3-dipolar compound
Propargyl-type 1,3-dipolar organic compound
Carboximidamide
Organic nitrogen compound
Organic oxygen compound
Organic oxide
Hydrocarbon derivative
Organooxygen compound
Organonitrogen compound
Carbonyl group
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)

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	-1.6	ALOGPS
logP	-2.6	ChemAxon
logS	-3.4	ALOGPS
pKa (Strongest Acidic)	13.09	ChemAxon
pKa (Strongest Basic)	11.66	ChemAxon
Physiological Charge	2	ChemAxon
Hydrogen Acceptor Count	8	ChemAxon
Hydrogen Donor Count	6	ChemAxon
Polar Surface Area	187 Å²	ChemAxon
Rotatable Bond Count	11	ChemAxon
Refractivity	83.64 m³·mol⁻¹	ChemAxon
Polarizability	34.89 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]+	173.413	30932474
DeepCCS	[M-H]-	171.055	30932474
DeepCCS	[M-2H]-	203.97	30932474
DeepCCS	[M+Na]+	179.506	30932474
AllCCS	[M+H]+	168.4	32859911
AllCCS	[M+H-H2O]+	165.9	32859911
AllCCS	[M+NH4]+	170.8	32859911
AllCCS	[M+Na]+	171.4	32859911
AllCCS	[M-H]-	178.2	32859911
AllCCS	[M+Na-2H]-	178.7	32859911
AllCCS	[M+HCOO]-	179.3	32859911

Predicted Kovats Retention Indices

Underivatized

Metabolite	SMILES	Kovats RI Value	Column Type	Reference
Bis(agmatine)oxalamide	NC(N)=NCCCCNC(=O)C(=O)NCCCCN=C(N)N	3490.9	Standard polar	33892256
Bis(agmatine)oxalamide	NC(N)=NCCCCNC(=O)C(=O)NCCCCN=C(N)N	3048.1	Standard non polar	33892256
Bis(agmatine)oxalamide	NC(N)=NCCCCNC(=O)C(=O)NCCCCN=C(N)N	3803.4	Semi standard non polar	33892256

Derivatized

Derivative Name / Structure	SMILES	Kovats RI Value	Column Type	Reference
Bis(agmatine)oxalamide,1TMS,isomer #1	C[Si](C)(C)NC(N)=NCCCCNC(=O)C(=O)NCCCCN=C(N)N	3522.8	Semi standard non polar	33892256
Bis(agmatine)oxalamide,1TMS,isomer #1	C[Si](C)(C)NC(N)=NCCCCNC(=O)C(=O)NCCCCN=C(N)N	2926.2	Standard non polar	33892256
Bis(agmatine)oxalamide,1TMS,isomer #1	C[Si](C)(C)NC(N)=NCCCCNC(=O)C(=O)NCCCCN=C(N)N	6732.8	Standard polar	33892256
Bis(agmatine)oxalamide,1TMS,isomer #2	C[Si](C)(C)N(CCCCN=C(N)N)C(=O)C(=O)NCCCCN=C(N)N	3228.6	Semi standard non polar	33892256
Bis(agmatine)oxalamide,1TMS,isomer #2	C[Si](C)(C)N(CCCCN=C(N)N)C(=O)C(=O)NCCCCN=C(N)N	2942.6	Standard non polar	33892256
Bis(agmatine)oxalamide,1TMS,isomer #2	C[Si](C)(C)N(CCCCN=C(N)N)C(=O)C(=O)NCCCCN=C(N)N	6647.7	Standard polar	33892256
Bis(agmatine)oxalamide,2TMS,isomer #1	C[Si](C)(C)NC(=NCCCCNC(=O)C(=O)NCCCCN=C(N)N)N[Si](C)(C)C	3545.6	Semi standard non polar	33892256
Bis(agmatine)oxalamide,2TMS,isomer #1	C[Si](C)(C)NC(=NCCCCNC(=O)C(=O)NCCCCN=C(N)N)N[Si](C)(C)C	2784.8	Standard non polar	33892256
Bis(agmatine)oxalamide,2TMS,isomer #1	C[Si](C)(C)NC(=NCCCCNC(=O)C(=O)NCCCCN=C(N)N)N[Si](C)(C)C	6581.1	Standard polar	33892256
Bis(agmatine)oxalamide,2TMS,isomer #2	C[Si](C)(C)NC(N)=NCCCCNC(=O)C(=O)NCCCCN=C(N)N[Si](C)(C)C	3531.6	Semi standard non polar	33892256
Bis(agmatine)oxalamide,2TMS,isomer #2	C[Si](C)(C)NC(N)=NCCCCNC(=O)C(=O)NCCCCN=C(N)N[Si](C)(C)C	2865.6	Standard non polar	33892256
Bis(agmatine)oxalamide,2TMS,isomer #2	C[Si](C)(C)NC(N)=NCCCCNC(=O)C(=O)NCCCCN=C(N)N[Si](C)(C)C	6591.4	Standard polar	33892256
Bis(agmatine)oxalamide,2TMS,isomer #3	C[Si](C)(C)N(C(N)=NCCCCNC(=O)C(=O)NCCCCN=C(N)N)[Si](C)(C)C	3458.1	Semi standard non polar	33892256
Bis(agmatine)oxalamide,2TMS,isomer #3	C[Si](C)(C)N(C(N)=NCCCCNC(=O)C(=O)NCCCCN=C(N)N)[Si](C)(C)C	2952.1	Standard non polar	33892256
Bis(agmatine)oxalamide,2TMS,isomer #3	C[Si](C)(C)N(C(N)=NCCCCNC(=O)C(=O)NCCCCN=C(N)N)[Si](C)(C)C	6641.5	Standard polar	33892256
Bis(agmatine)oxalamide,2TMS,isomer #4	C[Si](C)(C)NC(N)=NCCCCN(C(=O)C(=O)NCCCCN=C(N)N)[Si](C)(C)C	3282.4	Semi standard non polar	33892256
Bis(agmatine)oxalamide,2TMS,isomer #4	C[Si](C)(C)NC(N)=NCCCCN(C(=O)C(=O)NCCCCN=C(N)N)[Si](C)(C)C	2886.8	Standard non polar	33892256
Bis(agmatine)oxalamide,2TMS,isomer #4	C[Si](C)(C)NC(N)=NCCCCN(C(=O)C(=O)NCCCCN=C(N)N)[Si](C)(C)C	6514.1	Standard polar	33892256
Bis(agmatine)oxalamide,2TMS,isomer #5	C[Si](C)(C)NC(N)=NCCCCNC(=O)C(=O)N(CCCCN=C(N)N)[Si](C)(C)C	3287.0	Semi standard non polar	33892256
Bis(agmatine)oxalamide,2TMS,isomer #5	C[Si](C)(C)NC(N)=NCCCCNC(=O)C(=O)N(CCCCN=C(N)N)[Si](C)(C)C	2886.5	Standard non polar	33892256
Bis(agmatine)oxalamide,2TMS,isomer #5	C[Si](C)(C)NC(N)=NCCCCNC(=O)C(=O)N(CCCCN=C(N)N)[Si](C)(C)C	6514.1	Standard polar	33892256
Bis(agmatine)oxalamide,2TMS,isomer #6	C[Si](C)(C)N(CCCCN=C(N)N)C(=O)C(=O)N(CCCCN=C(N)N)[Si](C)(C)C	3099.1	Semi standard non polar	33892256
Bis(agmatine)oxalamide,2TMS,isomer #6	C[Si](C)(C)N(CCCCN=C(N)N)C(=O)C(=O)N(CCCCN=C(N)N)[Si](C)(C)C	2921.7	Standard non polar	33892256
Bis(agmatine)oxalamide,2TMS,isomer #6	C[Si](C)(C)N(CCCCN=C(N)N)C(=O)C(=O)N(CCCCN=C(N)N)[Si](C)(C)C	6533.2	Standard polar	33892256
Bis(agmatine)oxalamide,3TMS,isomer #1	C[Si](C)(C)NC(N)=NCCCCNC(=O)C(=O)NCCCCN=C(N[Si](C)(C)C)N[Si](C)(C)C	3606.0	Semi standard non polar	33892256
Bis(agmatine)oxalamide,3TMS,isomer #1	C[Si](C)(C)NC(N)=NCCCCNC(=O)C(=O)NCCCCN=C(N[Si](C)(C)C)N[Si](C)(C)C	2697.6	Standard non polar	33892256
Bis(agmatine)oxalamide,3TMS,isomer #1	C[Si](C)(C)NC(N)=NCCCCNC(=O)C(=O)NCCCCN=C(N[Si](C)(C)C)N[Si](C)(C)C	6390.5	Standard polar	33892256
Bis(agmatine)oxalamide,3TMS,isomer #2	C[Si](C)(C)NC(=NCCCCNC(=O)C(=O)NCCCCN=C(N)N)N([Si](C)(C)C)[Si](C)(C)C	3529.9	Semi standard non polar	33892256
Bis(agmatine)oxalamide,3TMS,isomer #2	C[Si](C)(C)NC(=NCCCCNC(=O)C(=O)NCCCCN=C(N)N)N([Si](C)(C)C)[Si](C)(C)C	2866.4	Standard non polar	33892256
Bis(agmatine)oxalamide,3TMS,isomer #2	C[Si](C)(C)NC(=NCCCCNC(=O)C(=O)NCCCCN=C(N)N)N([Si](C)(C)C)[Si](C)(C)C	6331.7	Standard polar	33892256
Bis(agmatine)oxalamide,3TMS,isomer #3	C[Si](C)(C)NC(=NCCCCN(C(=O)C(=O)NCCCCN=C(N)N)[Si](C)(C)C)N[Si](C)(C)C	3398.0	Semi standard non polar	33892256
Bis(agmatine)oxalamide,3TMS,isomer #3	C[Si](C)(C)NC(=NCCCCN(C(=O)C(=O)NCCCCN=C(N)N)[Si](C)(C)C)N[Si](C)(C)C	2719.0	Standard non polar	33892256
Bis(agmatine)oxalamide,3TMS,isomer #3	C[Si](C)(C)NC(=NCCCCN(C(=O)C(=O)NCCCCN=C(N)N)[Si](C)(C)C)N[Si](C)(C)C	6287.0	Standard polar	33892256
Bis(agmatine)oxalamide,3TMS,isomer #4	C[Si](C)(C)NC(=NCCCCNC(=O)C(=O)N(CCCCN=C(N)N)[Si](C)(C)C)N[Si](C)(C)C	3402.9	Semi standard non polar	33892256
Bis(agmatine)oxalamide,3TMS,isomer #4	C[Si](C)(C)NC(=NCCCCNC(=O)C(=O)N(CCCCN=C(N)N)[Si](C)(C)C)N[Si](C)(C)C	2718.9	Standard non polar	33892256
Bis(agmatine)oxalamide,3TMS,isomer #4	C[Si](C)(C)NC(=NCCCCNC(=O)C(=O)N(CCCCN=C(N)N)[Si](C)(C)C)N[Si](C)(C)C	6286.9	Standard polar	33892256
Bis(agmatine)oxalamide,3TMS,isomer #5	C[Si](C)(C)NC(N)=NCCCCNC(=O)C(=O)NCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	3556.1	Semi standard non polar	33892256
Bis(agmatine)oxalamide,3TMS,isomer #5	C[Si](C)(C)NC(N)=NCCCCNC(=O)C(=O)NCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	2889.1	Standard non polar	33892256
Bis(agmatine)oxalamide,3TMS,isomer #5	C[Si](C)(C)NC(N)=NCCCCNC(=O)C(=O)NCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	6450.4	Standard polar	33892256
Bis(agmatine)oxalamide,3TMS,isomer #6	C[Si](C)(C)NC(N)=NCCCCNC(=O)C(=O)N(CCCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C	3383.1	Semi standard non polar	33892256
Bis(agmatine)oxalamide,3TMS,isomer #6	C[Si](C)(C)NC(N)=NCCCCNC(=O)C(=O)N(CCCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C	2830.1	Standard non polar	33892256
Bis(agmatine)oxalamide,3TMS,isomer #6	C[Si](C)(C)NC(N)=NCCCCNC(=O)C(=O)N(CCCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C	6361.1	Standard polar	33892256
Bis(agmatine)oxalamide,3TMS,isomer #7	C[Si](C)(C)N(CCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)C(=O)C(=O)NCCCCN=C(N)N	3280.6	Semi standard non polar	33892256
Bis(agmatine)oxalamide,3TMS,isomer #7	C[Si](C)(C)N(CCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)C(=O)C(=O)NCCCCN=C(N)N	2941.6	Standard non polar	33892256
Bis(agmatine)oxalamide,3TMS,isomer #7	C[Si](C)(C)N(CCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)C(=O)C(=O)NCCCCN=C(N)N	6418.3	Standard polar	33892256
Bis(agmatine)oxalamide,3TMS,isomer #8	C[Si](C)(C)N(CCCCN=C(N)N)C(=O)C(=O)NCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	3278.0	Semi standard non polar	33892256
Bis(agmatine)oxalamide,3TMS,isomer #8	C[Si](C)(C)N(CCCCN=C(N)N)C(=O)C(=O)NCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	2940.0	Standard non polar	33892256
Bis(agmatine)oxalamide,3TMS,isomer #8	C[Si](C)(C)N(CCCCN=C(N)N)C(=O)C(=O)NCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	6418.5	Standard polar	33892256
Bis(agmatine)oxalamide,3TMS,isomer #9	C[Si](C)(C)NC(N)=NCCCCN(C(=O)C(=O)N(CCCCN=C(N)N)[Si](C)(C)C)[Si](C)(C)C	3202.4	Semi standard non polar	33892256
Bis(agmatine)oxalamide,3TMS,isomer #9	C[Si](C)(C)NC(N)=NCCCCN(C(=O)C(=O)N(CCCCN=C(N)N)[Si](C)(C)C)[Si](C)(C)C	2826.6	Standard non polar	33892256
Bis(agmatine)oxalamide,3TMS,isomer #9	C[Si](C)(C)NC(N)=NCCCCN(C(=O)C(=O)N(CCCCN=C(N)N)[Si](C)(C)C)[Si](C)(C)C	6391.7	Standard polar	33892256
Bis(agmatine)oxalamide,4TMS,isomer #1	C[Si](C)(C)NC(=NCCCCNC(=O)C(=O)NCCCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)N[Si](C)(C)C	3672.3	Semi standard non polar	33892256
Bis(agmatine)oxalamide,4TMS,isomer #1	C[Si](C)(C)NC(=NCCCCNC(=O)C(=O)NCCCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)N[Si](C)(C)C	2612.2	Standard non polar	33892256
Bis(agmatine)oxalamide,4TMS,isomer #1	C[Si](C)(C)NC(=NCCCCNC(=O)C(=O)NCCCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)N[Si](C)(C)C	6036.8	Standard polar	33892256
Bis(agmatine)oxalamide,4TMS,isomer #10	C[Si](C)(C)N(C(N)=NCCCCNC(=O)C(=O)NCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3557.5	Semi standard non polar	33892256
Bis(agmatine)oxalamide,4TMS,isomer #10	C[Si](C)(C)N(C(N)=NCCCCNC(=O)C(=O)NCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	2891.6	Standard non polar	33892256
Bis(agmatine)oxalamide,4TMS,isomer #10	C[Si](C)(C)N(C(N)=NCCCCNC(=O)C(=O)NCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	6248.0	Standard polar	33892256
Bis(agmatine)oxalamide,4TMS,isomer #11	C[Si](C)(C)NC(N)=NCCCCN(C(=O)C(=O)NCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3393.8	Semi standard non polar	33892256
Bis(agmatine)oxalamide,4TMS,isomer #11	C[Si](C)(C)NC(N)=NCCCCN(C(=O)C(=O)NCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	2860.9	Standard non polar	33892256
Bis(agmatine)oxalamide,4TMS,isomer #11	C[Si](C)(C)NC(N)=NCCCCN(C(=O)C(=O)NCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	6186.4	Standard polar	33892256
Bis(agmatine)oxalamide,4TMS,isomer #12	C[Si](C)(C)NC(N)=NCCCCNC(=O)C(=O)N(CCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3397.5	Semi standard non polar	33892256
Bis(agmatine)oxalamide,4TMS,isomer #12	C[Si](C)(C)NC(N)=NCCCCNC(=O)C(=O)N(CCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	2861.5	Standard non polar	33892256
Bis(agmatine)oxalamide,4TMS,isomer #12	C[Si](C)(C)NC(N)=NCCCCNC(=O)C(=O)N(CCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	6186.4	Standard polar	33892256
Bis(agmatine)oxalamide,4TMS,isomer #13	C[Si](C)(C)NC(N)=NCCCCN(C(=O)C(=O)N(CCCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3332.6	Semi standard non polar	33892256
Bis(agmatine)oxalamide,4TMS,isomer #13	C[Si](C)(C)NC(N)=NCCCCN(C(=O)C(=O)N(CCCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	2760.3	Standard non polar	33892256
Bis(agmatine)oxalamide,4TMS,isomer #13	C[Si](C)(C)NC(N)=NCCCCN(C(=O)C(=O)N(CCCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	6170.0	Standard polar	33892256
Bis(agmatine)oxalamide,4TMS,isomer #14	C[Si](C)(C)N(CCCCN=C(N)N)C(=O)C(=O)N(CCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3224.4	Semi standard non polar	33892256
Bis(agmatine)oxalamide,4TMS,isomer #14	C[Si](C)(C)N(CCCCN=C(N)N)C(=O)C(=O)N(CCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	2916.3	Standard non polar	33892256
Bis(agmatine)oxalamide,4TMS,isomer #14	C[Si](C)(C)N(CCCCN=C(N)N)C(=O)C(=O)N(CCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	6261.3	Standard polar	33892256
Bis(agmatine)oxalamide,4TMS,isomer #2	C[Si](C)(C)NC(=NCCCCNC(=O)C(=O)NCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	3638.1	Semi standard non polar	33892256
Bis(agmatine)oxalamide,4TMS,isomer #2	C[Si](C)(C)NC(=NCCCCNC(=O)C(=O)NCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	2700.2	Standard non polar	33892256
Bis(agmatine)oxalamide,4TMS,isomer #2	C[Si](C)(C)NC(=NCCCCNC(=O)C(=O)NCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	6063.4	Standard polar	33892256
Bis(agmatine)oxalamide,4TMS,isomer #3	C[Si](C)(C)NC(N)=NCCCCN(C(=O)C(=O)NCCCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C	3487.8	Semi standard non polar	33892256
Bis(agmatine)oxalamide,4TMS,isomer #3	C[Si](C)(C)NC(N)=NCCCCN(C(=O)C(=O)NCCCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C	2687.1	Standard non polar	33892256
Bis(agmatine)oxalamide,4TMS,isomer #3	C[Si](C)(C)NC(N)=NCCCCN(C(=O)C(=O)NCCCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C	6019.4	Standard polar	33892256
Bis(agmatine)oxalamide,4TMS,isomer #4	C[Si](C)(C)NC(N)=NCCCCNC(=O)C(=O)N(CCCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C	3486.0	Semi standard non polar	33892256
Bis(agmatine)oxalamide,4TMS,isomer #4	C[Si](C)(C)NC(N)=NCCCCNC(=O)C(=O)N(CCCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C	2684.4	Standard non polar	33892256
Bis(agmatine)oxalamide,4TMS,isomer #4	C[Si](C)(C)NC(N)=NCCCCNC(=O)C(=O)N(CCCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C	6019.6	Standard polar	33892256
Bis(agmatine)oxalamide,4TMS,isomer #5	C[Si](C)(C)NC(N)=NCCCCNC(=O)C(=O)NCCCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3602.6	Semi standard non polar	33892256
Bis(agmatine)oxalamide,4TMS,isomer #5	C[Si](C)(C)NC(N)=NCCCCNC(=O)C(=O)NCCCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2760.9	Standard non polar	33892256
Bis(agmatine)oxalamide,4TMS,isomer #5	C[Si](C)(C)NC(N)=NCCCCNC(=O)C(=O)NCCCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	5995.3	Standard polar	33892256
Bis(agmatine)oxalamide,4TMS,isomer #6	C[Si](C)(C)N(C(=NCCCCNC(=O)C(=O)NCCCCN=C(N)N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3490.2	Semi standard non polar	33892256
Bis(agmatine)oxalamide,4TMS,isomer #6	C[Si](C)(C)N(C(=NCCCCNC(=O)C(=O)NCCCCN=C(N)N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	2960.6	Standard non polar	33892256
Bis(agmatine)oxalamide,4TMS,isomer #6	C[Si](C)(C)N(C(=NCCCCNC(=O)C(=O)NCCCCN=C(N)N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	6047.2	Standard polar	33892256
Bis(agmatine)oxalamide,4TMS,isomer #7	C[Si](C)(C)NC(=NCCCCN(C(=O)C(=O)NCCCCN=C(N)N)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3356.6	Semi standard non polar	33892256
Bis(agmatine)oxalamide,4TMS,isomer #7	C[Si](C)(C)NC(=NCCCCN(C(=O)C(=O)NCCCCN=C(N)N)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2834.5	Standard non polar	33892256
Bis(agmatine)oxalamide,4TMS,isomer #7	C[Si](C)(C)NC(=NCCCCN(C(=O)C(=O)NCCCCN=C(N)N)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	6004.3	Standard polar	33892256
Bis(agmatine)oxalamide,4TMS,isomer #8	C[Si](C)(C)NC(=NCCCCNC(=O)C(=O)N(CCCCN=C(N)N)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3357.6	Semi standard non polar	33892256
Bis(agmatine)oxalamide,4TMS,isomer #8	C[Si](C)(C)NC(=NCCCCNC(=O)C(=O)N(CCCCN=C(N)N)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2838.2	Standard non polar	33892256
Bis(agmatine)oxalamide,4TMS,isomer #8	C[Si](C)(C)NC(=NCCCCNC(=O)C(=O)N(CCCCN=C(N)N)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	6004.1	Standard polar	33892256
Bis(agmatine)oxalamide,4TMS,isomer #9	C[Si](C)(C)NC(=NCCCCN(C(=O)C(=O)N(CCCCN=C(N)N)[Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	3328.9	Semi standard non polar	33892256
Bis(agmatine)oxalamide,4TMS,isomer #9	C[Si](C)(C)NC(=NCCCCN(C(=O)C(=O)N(CCCCN=C(N)N)[Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	2692.8	Standard non polar	33892256
Bis(agmatine)oxalamide,4TMS,isomer #9	C[Si](C)(C)NC(=NCCCCN(C(=O)C(=O)N(CCCCN=C(N)N)[Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	6050.3	Standard polar	33892256
Bis(agmatine)oxalamide,5TMS,isomer #1	C[Si](C)(C)NC(=NCCCCNC(=O)C(=O)NCCCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	3668.3	Semi standard non polar	33892256
Bis(agmatine)oxalamide,5TMS,isomer #1	C[Si](C)(C)NC(=NCCCCNC(=O)C(=O)NCCCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	2646.3	Standard non polar	33892256
Bis(agmatine)oxalamide,5TMS,isomer #1	C[Si](C)(C)NC(=NCCCCNC(=O)C(=O)NCCCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	5490.0	Standard polar	33892256
Bis(agmatine)oxalamide,5TMS,isomer #10	C[Si](C)(C)N(CCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)C(=O)C(=O)NCCCCN=C(N)N	3329.4	Semi standard non polar	33892256
Bis(agmatine)oxalamide,5TMS,isomer #10	C[Si](C)(C)N(CCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)C(=O)C(=O)NCCCCN=C(N)N	2982.1	Standard non polar	33892256
Bis(agmatine)oxalamide,5TMS,isomer #10	C[Si](C)(C)N(CCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)C(=O)C(=O)NCCCCN=C(N)N	5752.4	Standard polar	33892256
Bis(agmatine)oxalamide,5TMS,isomer #11	C[Si](C)(C)N(CCCCN=C(N)N)C(=O)C(=O)NCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3326.5	Semi standard non polar	33892256
Bis(agmatine)oxalamide,5TMS,isomer #11	C[Si](C)(C)N(CCCCN=C(N)N)C(=O)C(=O)NCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2984.8	Standard non polar	33892256
Bis(agmatine)oxalamide,5TMS,isomer #11	C[Si](C)(C)N(CCCCN=C(N)N)C(=O)C(=O)NCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	5752.1	Standard polar	33892256
Bis(agmatine)oxalamide,5TMS,isomer #12	C[Si](C)(C)NC(=NCCCCN(C(=O)C(=O)N(CCCCN=C(N)N)[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3283.0	Semi standard non polar	33892256
Bis(agmatine)oxalamide,5TMS,isomer #12	C[Si](C)(C)NC(=NCCCCN(C(=O)C(=O)N(CCCCN=C(N)N)[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2843.6	Standard non polar	33892256
Bis(agmatine)oxalamide,5TMS,isomer #12	C[Si](C)(C)NC(=NCCCCN(C(=O)C(=O)N(CCCCN=C(N)N)[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	5773.8	Standard polar	33892256
Bis(agmatine)oxalamide,5TMS,isomer #13	C[Si](C)(C)N(CCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)C(=O)C(=O)NCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	3464.3	Semi standard non polar	33892256
Bis(agmatine)oxalamide,5TMS,isomer #13	C[Si](C)(C)N(CCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)C(=O)C(=O)NCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	2929.4	Standard non polar	33892256
Bis(agmatine)oxalamide,5TMS,isomer #13	C[Si](C)(C)N(CCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)C(=O)C(=O)NCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	6024.0	Standard polar	33892256
Bis(agmatine)oxalamide,5TMS,isomer #14	C[Si](C)(C)NC(N)=NCCCCN(C(=O)C(=O)N(CCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3329.0	Semi standard non polar	33892256
Bis(agmatine)oxalamide,5TMS,isomer #14	C[Si](C)(C)NC(N)=NCCCCN(C(=O)C(=O)N(CCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	2840.9	Standard non polar	33892256
Bis(agmatine)oxalamide,5TMS,isomer #14	C[Si](C)(C)NC(N)=NCCCCN(C(=O)C(=O)N(CCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	6013.5	Standard polar	33892256
Bis(agmatine)oxalamide,5TMS,isomer #2	C[Si](C)(C)NC(=NCCCCNC(=O)C(=O)N(CCCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	3557.5	Semi standard non polar	33892256
Bis(agmatine)oxalamide,5TMS,isomer #2	C[Si](C)(C)NC(=NCCCCNC(=O)C(=O)N(CCCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	2633.2	Standard non polar	33892256
Bis(agmatine)oxalamide,5TMS,isomer #2	C[Si](C)(C)NC(=NCCCCNC(=O)C(=O)N(CCCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	5547.7	Standard polar	33892256
Bis(agmatine)oxalamide,5TMS,isomer #3	C[Si](C)(C)NC(=NCCCCNC(=O)C(=O)NCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3616.8	Semi standard non polar	33892256
Bis(agmatine)oxalamide,5TMS,isomer #3	C[Si](C)(C)NC(=NCCCCNC(=O)C(=O)NCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2799.6	Standard non polar	33892256
Bis(agmatine)oxalamide,5TMS,isomer #3	C[Si](C)(C)NC(=NCCCCNC(=O)C(=O)NCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	5712.4	Standard polar	33892256
Bis(agmatine)oxalamide,5TMS,isomer #4	C[Si](C)(C)NC(=NCCCCN(C(=O)C(=O)NCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	3485.3	Semi standard non polar	33892256
Bis(agmatine)oxalamide,5TMS,isomer #4	C[Si](C)(C)NC(=NCCCCN(C(=O)C(=O)NCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	2747.1	Standard non polar	33892256
Bis(agmatine)oxalamide,5TMS,isomer #4	C[Si](C)(C)NC(=NCCCCN(C(=O)C(=O)NCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	5745.2	Standard polar	33892256
Bis(agmatine)oxalamide,5TMS,isomer #5	C[Si](C)(C)NC(=NCCCCNC(=O)C(=O)N(CCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	3490.3	Semi standard non polar	33892256
Bis(agmatine)oxalamide,5TMS,isomer #5	C[Si](C)(C)NC(=NCCCCNC(=O)C(=O)N(CCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	2748.0	Standard non polar	33892256
Bis(agmatine)oxalamide,5TMS,isomer #5	C[Si](C)(C)NC(=NCCCCNC(=O)C(=O)N(CCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	5745.1	Standard polar	33892256
Bis(agmatine)oxalamide,5TMS,isomer #6	C[Si](C)(C)NC(N)=NCCCCN(C(=O)C(=O)N(CCCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3426.2	Semi standard non polar	33892256
Bis(agmatine)oxalamide,5TMS,isomer #6	C[Si](C)(C)NC(N)=NCCCCN(C(=O)C(=O)N(CCCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	2666.2	Standard non polar	33892256
Bis(agmatine)oxalamide,5TMS,isomer #6	C[Si](C)(C)NC(N)=NCCCCN(C(=O)C(=O)N(CCCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	5733.0	Standard polar	33892256
Bis(agmatine)oxalamide,5TMS,isomer #7	C[Si](C)(C)NC(N)=NCCCCN(C(=O)C(=O)NCCCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3440.9	Semi standard non polar	33892256
Bis(agmatine)oxalamide,5TMS,isomer #7	C[Si](C)(C)NC(N)=NCCCCN(C(=O)C(=O)NCCCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	2782.5	Standard non polar	33892256
Bis(agmatine)oxalamide,5TMS,isomer #7	C[Si](C)(C)NC(N)=NCCCCN(C(=O)C(=O)NCCCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	5676.1	Standard polar	33892256
Bis(agmatine)oxalamide,5TMS,isomer #8	C[Si](C)(C)NC(N)=NCCCCNC(=O)C(=O)N(CCCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3439.1	Semi standard non polar	33892256
Bis(agmatine)oxalamide,5TMS,isomer #8	C[Si](C)(C)NC(N)=NCCCCNC(=O)C(=O)N(CCCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	2782.3	Standard non polar	33892256
Bis(agmatine)oxalamide,5TMS,isomer #8	C[Si](C)(C)NC(N)=NCCCCNC(=O)C(=O)N(CCCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	5676.4	Standard polar	33892256
Bis(agmatine)oxalamide,5TMS,isomer #9	C[Si](C)(C)NC(N)=NCCCCNC(=O)C(=O)NCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3577.6	Semi standard non polar	33892256
Bis(agmatine)oxalamide,5TMS,isomer #9	C[Si](C)(C)NC(N)=NCCCCNC(=O)C(=O)NCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2838.7	Standard non polar	33892256
Bis(agmatine)oxalamide,5TMS,isomer #9	C[Si](C)(C)NC(N)=NCCCCNC(=O)C(=O)NCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	5679.5	Standard polar	33892256
Bis(agmatine)oxalamide,6TMS,isomer #1	C[Si](C)(C)NC(=NCCCCNC(=O)C(=O)NCCCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3640.5	Semi standard non polar	33892256
Bis(agmatine)oxalamide,6TMS,isomer #1	C[Si](C)(C)NC(=NCCCCNC(=O)C(=O)NCCCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2760.6	Standard non polar	33892256
Bis(agmatine)oxalamide,6TMS,isomer #1	C[Si](C)(C)NC(=NCCCCNC(=O)C(=O)NCCCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	5002.6	Standard polar	33892256
Bis(agmatine)oxalamide,6TMS,isomer #10	C[Si](C)(C)NC(N)=NCCCCN(C(=O)C(=O)N(CCCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3339.9	Semi standard non polar	33892256
Bis(agmatine)oxalamide,6TMS,isomer #10	C[Si](C)(C)NC(N)=NCCCCN(C(=O)C(=O)N(CCCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	2801.1	Standard non polar	33892256
Bis(agmatine)oxalamide,6TMS,isomer #10	C[Si](C)(C)NC(N)=NCCCCN(C(=O)C(=O)N(CCCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	5421.2	Standard polar	33892256
Bis(agmatine)oxalamide,6TMS,isomer #11	C[Si](C)(C)NC(N)=NCCCCN(C(=O)C(=O)NCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3401.5	Semi standard non polar	33892256
Bis(agmatine)oxalamide,6TMS,isomer #11	C[Si](C)(C)NC(N)=NCCCCN(C(=O)C(=O)NCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	2910.0	Standard non polar	33892256
Bis(agmatine)oxalamide,6TMS,isomer #11	C[Si](C)(C)NC(N)=NCCCCN(C(=O)C(=O)NCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	5379.5	Standard polar	33892256
Bis(agmatine)oxalamide,6TMS,isomer #12	C[Si](C)(C)NC(N)=NCCCCNC(=O)C(=O)N(CCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3404.8	Semi standard non polar	33892256
Bis(agmatine)oxalamide,6TMS,isomer #12	C[Si](C)(C)NC(N)=NCCCCNC(=O)C(=O)N(CCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	2909.4	Standard non polar	33892256
Bis(agmatine)oxalamide,6TMS,isomer #12	C[Si](C)(C)NC(N)=NCCCCNC(=O)C(=O)N(CCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	5379.7	Standard polar	33892256
Bis(agmatine)oxalamide,6TMS,isomer #13	C[Si](C)(C)N(CCCCN=C(N)N)C(=O)C(=O)N(CCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3280.4	Semi standard non polar	33892256
Bis(agmatine)oxalamide,6TMS,isomer #13	C[Si](C)(C)N(CCCCN=C(N)N)C(=O)C(=O)N(CCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3013.3	Standard non polar	33892256
Bis(agmatine)oxalamide,6TMS,isomer #13	C[Si](C)(C)N(CCCCN=C(N)N)C(=O)C(=O)N(CCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	5534.9	Standard polar	33892256
Bis(agmatine)oxalamide,6TMS,isomer #14	C[Si](C)(C)N(CCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)C(=O)C(=O)N(CCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3419.9	Semi standard non polar	33892256
Bis(agmatine)oxalamide,6TMS,isomer #14	C[Si](C)(C)N(CCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)C(=O)C(=O)N(CCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	2947.3	Standard non polar	33892256
Bis(agmatine)oxalamide,6TMS,isomer #14	C[Si](C)(C)N(CCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)C(=O)C(=O)N(CCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	5880.2	Standard polar	33892256
Bis(agmatine)oxalamide,6TMS,isomer #2	C[Si](C)(C)NC(=NCCCCN(C(=O)C(=O)NCCCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	3510.3	Semi standard non polar	33892256
Bis(agmatine)oxalamide,6TMS,isomer #2	C[Si](C)(C)NC(=NCCCCN(C(=O)C(=O)NCCCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	2728.0	Standard non polar	33892256
Bis(agmatine)oxalamide,6TMS,isomer #2	C[Si](C)(C)NC(=NCCCCN(C(=O)C(=O)NCCCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	5045.2	Standard polar	33892256
Bis(agmatine)oxalamide,6TMS,isomer #3	C[Si](C)(C)NC(=NCCCCNC(=O)C(=O)N(CCCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	3509.8	Semi standard non polar	33892256
Bis(agmatine)oxalamide,6TMS,isomer #3	C[Si](C)(C)NC(=NCCCCNC(=O)C(=O)N(CCCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	2728.4	Standard non polar	33892256
Bis(agmatine)oxalamide,6TMS,isomer #3	C[Si](C)(C)NC(=NCCCCNC(=O)C(=O)N(CCCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	5045.3	Standard polar	33892256
Bis(agmatine)oxalamide,6TMS,isomer #4	C[Si](C)(C)NC(=NCCCCNC(=O)C(=O)NCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	3647.5	Semi standard non polar	33892256
Bis(agmatine)oxalamide,6TMS,isomer #4	C[Si](C)(C)NC(=NCCCCNC(=O)C(=O)NCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	2743.6	Standard non polar	33892256
Bis(agmatine)oxalamide,6TMS,isomer #4	C[Si](C)(C)NC(=NCCCCNC(=O)C(=O)NCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	5022.7	Standard polar	33892256
Bis(agmatine)oxalamide,6TMS,isomer #5	C[Si](C)(C)NC(=NCCCCN(C(=O)C(=O)N(CCCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	3516.7	Semi standard non polar	33892256
Bis(agmatine)oxalamide,6TMS,isomer #5	C[Si](C)(C)NC(=NCCCCN(C(=O)C(=O)N(CCCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	2636.3	Standard non polar	33892256
Bis(agmatine)oxalamide,6TMS,isomer #5	C[Si](C)(C)NC(=NCCCCN(C(=O)C(=O)N(CCCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	5115.0	Standard polar	33892256
Bis(agmatine)oxalamide,6TMS,isomer #6	C[Si](C)(C)N(C(N)=NCCCCNC(=O)C(=O)NCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3594.3	Semi standard non polar	33892256
Bis(agmatine)oxalamide,6TMS,isomer #6	C[Si](C)(C)N(C(N)=NCCCCNC(=O)C(=O)NCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	2918.0	Standard non polar	33892256
Bis(agmatine)oxalamide,6TMS,isomer #6	C[Si](C)(C)N(C(N)=NCCCCNC(=O)C(=O)NCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	5423.8	Standard polar	33892256
Bis(agmatine)oxalamide,6TMS,isomer #7	C[Si](C)(C)NC(=NCCCCN(C(=O)C(=O)NCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3482.7	Semi standard non polar	33892256
Bis(agmatine)oxalamide,6TMS,isomer #7	C[Si](C)(C)NC(=NCCCCN(C(=O)C(=O)NCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2872.7	Standard non polar	33892256
Bis(agmatine)oxalamide,6TMS,isomer #7	C[Si](C)(C)NC(=NCCCCN(C(=O)C(=O)NCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	5440.3	Standard polar	33892256
Bis(agmatine)oxalamide,6TMS,isomer #8	C[Si](C)(C)NC(=NCCCCNC(=O)C(=O)N(CCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3487.3	Semi standard non polar	33892256
Bis(agmatine)oxalamide,6TMS,isomer #8	C[Si](C)(C)NC(=NCCCCNC(=O)C(=O)N(CCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2872.7	Standard non polar	33892256
Bis(agmatine)oxalamide,6TMS,isomer #8	C[Si](C)(C)NC(=NCCCCNC(=O)C(=O)N(CCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	5440.3	Standard polar	33892256
Bis(agmatine)oxalamide,6TMS,isomer #9	C[Si](C)(C)NC(=NCCCCN(C(=O)C(=O)N(CCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	3394.4	Semi standard non polar	33892256
Bis(agmatine)oxalamide,6TMS,isomer #9	C[Si](C)(C)NC(=NCCCCN(C(=O)C(=O)N(CCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	2777.7	Standard non polar	33892256
Bis(agmatine)oxalamide,6TMS,isomer #9	C[Si](C)(C)NC(=NCCCCN(C(=O)C(=O)N(CCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	5498.6	Standard polar	33892256
Bis(agmatine)oxalamide,7TMS,isomer #1	C[Si](C)(C)NC(=NCCCCNC(=O)C(=O)NCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3653.1	Semi standard non polar	33892256
Bis(agmatine)oxalamide,7TMS,isomer #1	C[Si](C)(C)NC(=NCCCCNC(=O)C(=O)NCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2898.3	Standard non polar	33892256
Bis(agmatine)oxalamide,7TMS,isomer #1	C[Si](C)(C)NC(=NCCCCNC(=O)C(=O)NCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	4498.5	Standard polar	33892256
Bis(agmatine)oxalamide,7TMS,isomer #2	C[Si](C)(C)NC(=NCCCCNC(=O)C(=O)N(CCCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3496.1	Semi standard non polar	33892256
Bis(agmatine)oxalamide,7TMS,isomer #2	C[Si](C)(C)NC(=NCCCCNC(=O)C(=O)N(CCCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2861.0	Standard non polar	33892256
Bis(agmatine)oxalamide,7TMS,isomer #2	C[Si](C)(C)NC(=NCCCCNC(=O)C(=O)N(CCCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	4549.5	Standard polar	33892256
Bis(agmatine)oxalamide,7TMS,isomer #3	C[Si](C)(C)NC(=NCCCCN(C(=O)C(=O)N(CCCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	3403.5	Semi standard non polar	33892256
Bis(agmatine)oxalamide,7TMS,isomer #3	C[Si](C)(C)NC(=NCCCCN(C(=O)C(=O)N(CCCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	2774.0	Standard non polar	33892256
Bis(agmatine)oxalamide,7TMS,isomer #3	C[Si](C)(C)NC(=NCCCCN(C(=O)C(=O)N(CCCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	4626.3	Standard polar	33892256
Bis(agmatine)oxalamide,7TMS,isomer #4	C[Si](C)(C)NC(=NCCCCN(C(=O)C(=O)NCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	3468.1	Semi standard non polar	33892256
Bis(agmatine)oxalamide,7TMS,isomer #4	C[Si](C)(C)NC(=NCCCCN(C(=O)C(=O)NCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	2857.0	Standard non polar	33892256
Bis(agmatine)oxalamide,7TMS,isomer #4	C[Si](C)(C)NC(=NCCCCN(C(=O)C(=O)NCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	4550.9	Standard polar	33892256
Bis(agmatine)oxalamide,7TMS,isomer #5	C[Si](C)(C)NC(=NCCCCNC(=O)C(=O)N(CCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	3467.5	Semi standard non polar	33892256
Bis(agmatine)oxalamide,7TMS,isomer #5	C[Si](C)(C)NC(=NCCCCNC(=O)C(=O)N(CCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	2857.5	Standard non polar	33892256
Bis(agmatine)oxalamide,7TMS,isomer #5	C[Si](C)(C)NC(=NCCCCNC(=O)C(=O)N(CCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N[Si](C)(C)C	4550.7	Standard polar	33892256
Bis(agmatine)oxalamide,7TMS,isomer #6	C[Si](C)(C)N(CCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)C(=O)C(=O)NCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3486.2	Semi standard non polar	33892256
Bis(agmatine)oxalamide,7TMS,isomer #6	C[Si](C)(C)N(CCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)C(=O)C(=O)NCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3016.3	Standard non polar	33892256
Bis(agmatine)oxalamide,7TMS,isomer #6	C[Si](C)(C)N(CCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)C(=O)C(=O)NCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	5148.9	Standard polar	33892256
Bis(agmatine)oxalamide,7TMS,isomer #7	C[Si](C)(C)N(CCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)C(=O)C(=O)NCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	3484.5	Semi standard non polar	33892256
Bis(agmatine)oxalamide,7TMS,isomer #7	C[Si](C)(C)N(CCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)C(=O)C(=O)NCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	3015.7	Standard non polar	33892256
Bis(agmatine)oxalamide,7TMS,isomer #7	C[Si](C)(C)N(CCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)C(=O)C(=O)NCCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	5149.2	Standard polar	33892256
Bis(agmatine)oxalamide,7TMS,isomer #8	C[Si](C)(C)NC(=NCCCCN(C(=O)C(=O)N(CCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3430.9	Semi standard non polar	33892256
Bis(agmatine)oxalamide,7TMS,isomer #8	C[Si](C)(C)NC(=NCCCCN(C(=O)C(=O)N(CCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2928.8	Standard non polar	33892256
Bis(agmatine)oxalamide,7TMS,isomer #8	C[Si](C)(C)NC(=NCCCCN(C(=O)C(=O)N(CCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	5207.5	Standard polar	33892256
Bis(agmatine)oxalamide,7TMS,isomer #9	C[Si](C)(C)NC(N)=NCCCCN(C(=O)C(=O)N(CCCCN=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	3341.3	Semi standard non polar	33892256
Bis(agmatine)oxalamide,7TMS,isomer #9	C[Si](C)(C)NC(N)=NCCCCN(C(=O)C(=O)N(CCCCN=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	2962.9	Standard non polar	33892256
Bis(agmatine)oxalamide,7TMS,isomer #9	C[Si](C)(C)NC(N)=NCCCCN(C(=O)C(=O)N(CCCCN=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	5114.8	Standard polar	33892256
Bis(agmatine)oxalamide,8TMS,isomer #1	C[Si](C)(C)N(C(=NCCCCNC(=O)C(=O)NCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3627.9	Semi standard non polar	33892256
Bis(agmatine)oxalamide,8TMS,isomer #1	C[Si](C)(C)N(C(=NCCCCNC(=O)C(=O)NCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3069.6	Standard non polar	33892256
Bis(agmatine)oxalamide,8TMS,isomer #1	C[Si](C)(C)N(C(=NCCCCNC(=O)C(=O)NCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4050.2	Standard polar	33892256
Bis(agmatine)oxalamide,8TMS,isomer #2	C[Si](C)(C)NC(=NCCCCN(C(=O)C(=O)NCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3488.5	Semi standard non polar	33892256
Bis(agmatine)oxalamide,8TMS,isomer #2	C[Si](C)(C)NC(=NCCCCN(C(=O)C(=O)NCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3009.2	Standard non polar	33892256
Bis(agmatine)oxalamide,8TMS,isomer #2	C[Si](C)(C)NC(=NCCCCN(C(=O)C(=O)NCCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	4095.6	Standard polar	33892256
Bis(agmatine)oxalamide,8TMS,isomer #3	C[Si](C)(C)NC(=NCCCCNC(=O)C(=O)N(CCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3490.4	Semi standard non polar	33892256
Bis(agmatine)oxalamide,8TMS,isomer #3	C[Si](C)(C)NC(=NCCCCNC(=O)C(=O)N(CCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3008.5	Standard non polar	33892256
Bis(agmatine)oxalamide,8TMS,isomer #3	C[Si](C)(C)NC(=NCCCCNC(=O)C(=O)N(CCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	4095.5	Standard polar	33892256
Bis(agmatine)oxalamide,8TMS,isomer #4	C[Si](C)(C)NC(=NCCCCN(C(=O)C(=O)N(CCCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3426.8	Semi standard non polar	33892256
Bis(agmatine)oxalamide,8TMS,isomer #4	C[Si](C)(C)NC(=NCCCCN(C(=O)C(=O)N(CCCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	2933.5	Standard non polar	33892256
Bis(agmatine)oxalamide,8TMS,isomer #4	C[Si](C)(C)NC(=NCCCCN(C(=O)C(=O)N(CCCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	4168.0	Standard polar	33892256
Bis(agmatine)oxalamide,8TMS,isomer #5	C[Si](C)(C)NC(=NCCCCN(C(=O)C(=O)N(CCCCN=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)N[Si](C)(C)C	3423.5	Semi standard non polar	33892256
Bis(agmatine)oxalamide,8TMS,isomer #5	C[Si](C)(C)NC(=NCCCCN(C(=O)C(=O)N(CCCCN=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)N[Si](C)(C)C	2942.8	Standard non polar	33892256
Bis(agmatine)oxalamide,8TMS,isomer #5	C[Si](C)(C)NC(=NCCCCN(C(=O)C(=O)N(CCCCN=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)N[Si](C)(C)C	4171.3	Standard polar	33892256
Bis(agmatine)oxalamide,8TMS,isomer #6	C[Si](C)(C)N(CCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)C(=O)C(=O)N(CCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3468.8	Semi standard non polar	33892256
Bis(agmatine)oxalamide,8TMS,isomer #6	C[Si](C)(C)N(CCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)C(=O)C(=O)N(CCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3090.7	Standard non polar	33892256
Bis(agmatine)oxalamide,8TMS,isomer #6	C[Si](C)(C)N(CCCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)C(=O)C(=O)N(CCCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4911.0	Standard polar	33892256
Bis(agmatine)oxalamide,1TBDMS,isomer #1	CC(C)(C)[Si](C)(C)NC(N)=NCCCCNC(=O)C(=O)NCCCCN=C(N)N	3643.1	Semi standard non polar	33892256
Bis(agmatine)oxalamide,1TBDMS,isomer #1	CC(C)(C)[Si](C)(C)NC(N)=NCCCCNC(=O)C(=O)NCCCCN=C(N)N	3071.6	Standard non polar	33892256
Bis(agmatine)oxalamide,1TBDMS,isomer #1	CC(C)(C)[Si](C)(C)NC(N)=NCCCCNC(=O)C(=O)NCCCCN=C(N)N	6661.1	Standard polar	33892256
Bis(agmatine)oxalamide,1TBDMS,isomer #2	CC(C)(C)[Si](C)(C)N(CCCCN=C(N)N)C(=O)C(=O)NCCCCN=C(N)N	3437.5	Semi standard non polar	33892256
Bis(agmatine)oxalamide,1TBDMS,isomer #2	CC(C)(C)[Si](C)(C)N(CCCCN=C(N)N)C(=O)C(=O)NCCCCN=C(N)N	3136.5	Standard non polar	33892256
Bis(agmatine)oxalamide,1TBDMS,isomer #2	CC(C)(C)[Si](C)(C)N(CCCCN=C(N)N)C(=O)C(=O)NCCCCN=C(N)N	6644.2	Standard polar	33892256
Bis(agmatine)oxalamide,2TBDMS,isomer #1	CC(C)(C)[Si](C)(C)NC(=NCCCCNC(=O)C(=O)NCCCCN=C(N)N)N[Si](C)(C)C(C)(C)C	3900.6	Semi standard non polar	33892256
Bis(agmatine)oxalamide,2TBDMS,isomer #1	CC(C)(C)[Si](C)(C)NC(=NCCCCNC(=O)C(=O)NCCCCN=C(N)N)N[Si](C)(C)C(C)(C)C	3042.4	Standard non polar	33892256
Bis(agmatine)oxalamide,2TBDMS,isomer #1	CC(C)(C)[Si](C)(C)NC(=NCCCCNC(=O)C(=O)NCCCCN=C(N)N)N[Si](C)(C)C(C)(C)C	6353.1	Standard polar	33892256
Bis(agmatine)oxalamide,2TBDMS,isomer #2	CC(C)(C)[Si](C)(C)NC(N)=NCCCCNC(=O)C(=O)NCCCCN=C(N)N[Si](C)(C)C(C)(C)C	3860.6	Semi standard non polar	33892256
Bis(agmatine)oxalamide,2TBDMS,isomer #2	CC(C)(C)[Si](C)(C)NC(N)=NCCCCNC(=O)C(=O)NCCCCN=C(N)N[Si](C)(C)C(C)(C)C	3088.1	Standard non polar	33892256
Bis(agmatine)oxalamide,2TBDMS,isomer #2	CC(C)(C)[Si](C)(C)NC(N)=NCCCCNC(=O)C(=O)NCCCCN=C(N)N[Si](C)(C)C(C)(C)C	6462.7	Standard polar	33892256
Bis(agmatine)oxalamide,2TBDMS,isomer #3	CC(C)(C)[Si](C)(C)N(C(N)=NCCCCNC(=O)C(=O)NCCCCN=C(N)N)[Si](C)(C)C(C)(C)C	3805.0	Semi standard non polar	33892256
Bis(agmatine)oxalamide,2TBDMS,isomer #3	CC(C)(C)[Si](C)(C)N(C(N)=NCCCCNC(=O)C(=O)NCCCCN=C(N)N)[Si](C)(C)C(C)(C)C	3247.9	Standard non polar	33892256
Bis(agmatine)oxalamide,2TBDMS,isomer #3	CC(C)(C)[Si](C)(C)N(C(N)=NCCCCNC(=O)C(=O)NCCCCN=C(N)N)[Si](C)(C)C(C)(C)C	6552.9	Standard polar	33892256
Bis(agmatine)oxalamide,2TBDMS,isomer #4	CC(C)(C)[Si](C)(C)NC(N)=NCCCCN(C(=O)C(=O)NCCCCN=C(N)N)[Si](C)(C)C(C)(C)C	3695.5	Semi standard non polar	33892256
Bis(agmatine)oxalamide,2TBDMS,isomer #4	CC(C)(C)[Si](C)(C)NC(N)=NCCCCN(C(=O)C(=O)NCCCCN=C(N)N)[Si](C)(C)C(C)(C)C	3199.2	Standard non polar	33892256
Bis(agmatine)oxalamide,2TBDMS,isomer #4	CC(C)(C)[Si](C)(C)NC(N)=NCCCCN(C(=O)C(=O)NCCCCN=C(N)N)[Si](C)(C)C(C)(C)C	6475.1	Standard polar	33892256
Bis(agmatine)oxalamide,2TBDMS,isomer #5	CC(C)(C)[Si](C)(C)NC(N)=NCCCCNC(=O)C(=O)N(CCCCN=C(N)N)[Si](C)(C)C(C)(C)C	3693.6	Semi standard non polar	33892256
Bis(agmatine)oxalamide,2TBDMS,isomer #5	CC(C)(C)[Si](C)(C)NC(N)=NCCCCNC(=O)C(=O)N(CCCCN=C(N)N)[Si](C)(C)C(C)(C)C	3199.8	Standard non polar	33892256
Bis(agmatine)oxalamide,2TBDMS,isomer #5	CC(C)(C)[Si](C)(C)NC(N)=NCCCCNC(=O)C(=O)N(CCCCN=C(N)N)[Si](C)(C)C(C)(C)C	6475.1	Standard polar	33892256
Bis(agmatine)oxalamide,2TBDMS,isomer #6	CC(C)(C)[Si](C)(C)N(CCCCN=C(N)N)C(=O)C(=O)N(CCCCN=C(N)N)[Si](C)(C)C(C)(C)C	3538.7	Semi standard non polar	33892256
Bis(agmatine)oxalamide,2TBDMS,isomer #6	CC(C)(C)[Si](C)(C)N(CCCCN=C(N)N)C(=O)C(=O)N(CCCCN=C(N)N)[Si](C)(C)C(C)(C)C	3274.2	Standard non polar	33892256
Bis(agmatine)oxalamide,2TBDMS,isomer #6	CC(C)(C)[Si](C)(C)N(CCCCN=C(N)N)C(=O)C(=O)N(CCCCN=C(N)N)[Si](C)(C)C(C)(C)C	6559.8	Standard polar	33892256
Bis(agmatine)oxalamide,3TBDMS,isomer #1	CC(C)(C)[Si](C)(C)NC(N)=NCCCCNC(=O)C(=O)NCCCCN=C(N[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C	4143.5	Semi standard non polar	33892256
Bis(agmatine)oxalamide,3TBDMS,isomer #1	CC(C)(C)[Si](C)(C)NC(N)=NCCCCNC(=O)C(=O)NCCCCN=C(N[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C	3025.7	Standard non polar	33892256
Bis(agmatine)oxalamide,3TBDMS,isomer #1	CC(C)(C)[Si](C)(C)NC(N)=NCCCCNC(=O)C(=O)NCCCCN=C(N[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C	6051.2	Standard polar	33892256
Bis(agmatine)oxalamide,3TBDMS,isomer #2	CC(C)(C)[Si](C)(C)NC(=NCCCCNC(=O)C(=O)NCCCCN=C(N)N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4038.7	Semi standard non polar	33892256
Bis(agmatine)oxalamide,3TBDMS,isomer #2	CC(C)(C)[Si](C)(C)NC(=NCCCCNC(=O)C(=O)NCCCCN=C(N)N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3301.9	Standard non polar	33892256
Bis(agmatine)oxalamide,3TBDMS,isomer #2	CC(C)(C)[Si](C)(C)NC(=NCCCCNC(=O)C(=O)NCCCCN=C(N)N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	6075.8	Standard polar	33892256
Bis(agmatine)oxalamide,3TBDMS,isomer #3	CC(C)(C)[Si](C)(C)NC(=NCCCCN(C(=O)C(=O)NCCCCN=C(N)N)[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C	3969.2	Semi standard non polar	33892256
Bis(agmatine)oxalamide,3TBDMS,isomer #3	CC(C)(C)[Si](C)(C)NC(=NCCCCN(C(=O)C(=O)NCCCCN=C(N)N)[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C	3168.0	Standard non polar	33892256
Bis(agmatine)oxalamide,3TBDMS,isomer #3	CC(C)(C)[Si](C)(C)NC(=NCCCCN(C(=O)C(=O)NCCCCN=C(N)N)[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C	6066.3	Standard polar	33892256
Bis(agmatine)oxalamide,3TBDMS,isomer #4	CC(C)(C)[Si](C)(C)NC(=NCCCCNC(=O)C(=O)N(CCCCN=C(N)N)[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C	3970.3	Semi standard non polar	33892256
Bis(agmatine)oxalamide,3TBDMS,isomer #4	CC(C)(C)[Si](C)(C)NC(=NCCCCNC(=O)C(=O)N(CCCCN=C(N)N)[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C	3168.4	Standard non polar	33892256
Bis(agmatine)oxalamide,3TBDMS,isomer #4	CC(C)(C)[Si](C)(C)NC(=NCCCCNC(=O)C(=O)N(CCCCN=C(N)N)[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C	6066.2	Standard polar	33892256
Bis(agmatine)oxalamide,3TBDMS,isomer #5	CC(C)(C)[Si](C)(C)NC(N)=NCCCCNC(=O)C(=O)NCCCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4053.8	Semi standard non polar	33892256
Bis(agmatine)oxalamide,3TBDMS,isomer #5	CC(C)(C)[Si](C)(C)NC(N)=NCCCCNC(=O)C(=O)NCCCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3249.0	Standard non polar	33892256
Bis(agmatine)oxalamide,3TBDMS,isomer #5	CC(C)(C)[Si](C)(C)NC(N)=NCCCCNC(=O)C(=O)NCCCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	6274.3	Standard polar	33892256
Bis(agmatine)oxalamide,3TBDMS,isomer #6	CC(C)(C)[Si](C)(C)NC(N)=NCCCCNC(=O)C(=O)N(CCCCN=C(N)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3923.3	Semi standard non polar	33892256
Bis(agmatine)oxalamide,3TBDMS,isomer #6	CC(C)(C)[Si](C)(C)NC(N)=NCCCCNC(=O)C(=O)N(CCCCN=C(N)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3226.3	Standard non polar	33892256
Bis(agmatine)oxalamide,3TBDMS,isomer #6	CC(C)(C)[Si](C)(C)NC(N)=NCCCCNC(=O)C(=O)N(CCCCN=C(N)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	6238.4	Standard polar	33892256
Bis(agmatine)oxalamide,3TBDMS,isomer #7	CC(C)(C)[Si](C)(C)N(CCCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)C(=O)NCCCCN=C(N)N	3843.3	Semi standard non polar	33892256
Bis(agmatine)oxalamide,3TBDMS,isomer #7	CC(C)(C)[Si](C)(C)N(CCCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)C(=O)NCCCCN=C(N)N	3425.5	Standard non polar	33892256
Bis(agmatine)oxalamide,3TBDMS,isomer #7	CC(C)(C)[Si](C)(C)N(CCCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)C(=O)NCCCCN=C(N)N	6349.8	Standard polar	33892256
Bis(agmatine)oxalamide,3TBDMS,isomer #8	CC(C)(C)[Si](C)(C)N(CCCCN=C(N)N)C(=O)C(=O)NCCCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3842.1	Semi standard non polar	33892256
Bis(agmatine)oxalamide,3TBDMS,isomer #8	CC(C)(C)[Si](C)(C)N(CCCCN=C(N)N)C(=O)C(=O)NCCCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3424.6	Standard non polar	33892256
Bis(agmatine)oxalamide,3TBDMS,isomer #8	CC(C)(C)[Si](C)(C)N(CCCCN=C(N)N)C(=O)C(=O)NCCCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	6349.7	Standard polar	33892256
Bis(agmatine)oxalamide,3TBDMS,isomer #9	CC(C)(C)[Si](C)(C)NC(N)=NCCCCN(C(=O)C(=O)N(CCCCN=C(N)N)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3804.3	Semi standard non polar	33892256
Bis(agmatine)oxalamide,3TBDMS,isomer #9	CC(C)(C)[Si](C)(C)NC(N)=NCCCCN(C(=O)C(=O)N(CCCCN=C(N)N)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3324.7	Standard non polar	33892256
Bis(agmatine)oxalamide,3TBDMS,isomer #9	CC(C)(C)[Si](C)(C)NC(N)=NCCCCN(C(=O)C(=O)N(CCCCN=C(N)N)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	6349.6	Standard polar	33892256
Bis(agmatine)oxalamide,4TBDMS,isomer #1	CC(C)(C)[Si](C)(C)NC(=NCCCCNC(=O)C(=O)NCCCCN=C(N[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C	4426.7	Semi standard non polar	33892256
Bis(agmatine)oxalamide,4TBDMS,isomer #1	CC(C)(C)[Si](C)(C)NC(=NCCCCNC(=O)C(=O)NCCCCN=C(N[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C	3068.7	Standard non polar	33892256
Bis(agmatine)oxalamide,4TBDMS,isomer #1	CC(C)(C)[Si](C)(C)NC(=NCCCCNC(=O)C(=O)NCCCCN=C(N[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C	5538.9	Standard polar	33892256
Bis(agmatine)oxalamide,4TBDMS,isomer #10	CC(C)(C)[Si](C)(C)N(C(N)=NCCCCNC(=O)C(=O)NCCCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4216.4	Semi standard non polar	33892256
Bis(agmatine)oxalamide,4TBDMS,isomer #10	CC(C)(C)[Si](C)(C)N(C(N)=NCCCCNC(=O)C(=O)NCCCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3425.9	Standard non polar	33892256
Bis(agmatine)oxalamide,4TBDMS,isomer #10	CC(C)(C)[Si](C)(C)N(C(N)=NCCCCNC(=O)C(=O)NCCCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	6139.4	Standard polar	33892256
Bis(agmatine)oxalamide,4TBDMS,isomer #11	CC(C)(C)[Si](C)(C)NC(N)=NCCCCN(C(=O)C(=O)NCCCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4101.2	Semi standard non polar	33892256
Bis(agmatine)oxalamide,4TBDMS,isomer #11	CC(C)(C)[Si](C)(C)NC(N)=NCCCCN(C(=O)C(=O)NCCCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3416.7	Standard non polar	33892256
Bis(agmatine)oxalamide,4TBDMS,isomer #11	CC(C)(C)[Si](C)(C)NC(N)=NCCCCN(C(=O)C(=O)NCCCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	6110.1	Standard polar	33892256
Bis(agmatine)oxalamide,4TBDMS,isomer #12	CC(C)(C)[Si](C)(C)NC(N)=NCCCCNC(=O)C(=O)N(CCCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4104.2	Semi standard non polar	33892256
Bis(agmatine)oxalamide,4TBDMS,isomer #12	CC(C)(C)[Si](C)(C)NC(N)=NCCCCNC(=O)C(=O)N(CCCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3416.7	Standard non polar	33892256
Bis(agmatine)oxalamide,4TBDMS,isomer #12	CC(C)(C)[Si](C)(C)NC(N)=NCCCCNC(=O)C(=O)N(CCCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	6110.1	Standard polar	33892256
Bis(agmatine)oxalamide,4TBDMS,isomer #13	CC(C)(C)[Si](C)(C)NC(N)=NCCCCN(C(=O)C(=O)N(CCCCN=C(N)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4021.1	Semi standard non polar	33892256
Bis(agmatine)oxalamide,4TBDMS,isomer #13	CC(C)(C)[Si](C)(C)NC(N)=NCCCCN(C(=O)C(=O)N(CCCCN=C(N)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3339.5	Standard non polar	33892256
Bis(agmatine)oxalamide,4TBDMS,isomer #13	CC(C)(C)[Si](C)(C)NC(N)=NCCCCN(C(=O)C(=O)N(CCCCN=C(N)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	6114.8	Standard polar	33892256
Bis(agmatine)oxalamide,4TBDMS,isomer #14	CC(C)(C)[Si](C)(C)N(CCCCN=C(N)N)C(=O)C(=O)N(CCCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3934.6	Semi standard non polar	33892256
Bis(agmatine)oxalamide,4TBDMS,isomer #14	CC(C)(C)[Si](C)(C)N(CCCCN=C(N)N)C(=O)C(=O)N(CCCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3559.1	Standard non polar	33892256
Bis(agmatine)oxalamide,4TBDMS,isomer #14	CC(C)(C)[Si](C)(C)N(CCCCN=C(N)N)C(=O)C(=O)N(CCCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	6264.6	Standard polar	33892256
Bis(agmatine)oxalamide,4TBDMS,isomer #2	CC(C)(C)[Si](C)(C)NC(=NCCCCNC(=O)C(=O)NCCCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C	4310.4	Semi standard non polar	33892256
Bis(agmatine)oxalamide,4TBDMS,isomer #2	CC(C)(C)[Si](C)(C)NC(=NCCCCNC(=O)C(=O)NCCCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C	3232.4	Standard non polar	33892256
Bis(agmatine)oxalamide,4TBDMS,isomer #2	CC(C)(C)[Si](C)(C)NC(=NCCCCNC(=O)C(=O)NCCCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C	5791.3	Standard polar	33892256
Bis(agmatine)oxalamide,4TBDMS,isomer #3	CC(C)(C)[Si](C)(C)NC(N)=NCCCCN(C(=O)C(=O)NCCCCN=C(N[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4209.5	Semi standard non polar	33892256
Bis(agmatine)oxalamide,4TBDMS,isomer #3	CC(C)(C)[Si](C)(C)NC(N)=NCCCCN(C(=O)C(=O)NCCCCN=C(N[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3206.4	Standard non polar	33892256
Bis(agmatine)oxalamide,4TBDMS,isomer #3	CC(C)(C)[Si](C)(C)NC(N)=NCCCCN(C(=O)C(=O)NCCCCN=C(N[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	5765.3	Standard polar	33892256
Bis(agmatine)oxalamide,4TBDMS,isomer #4	CC(C)(C)[Si](C)(C)NC(N)=NCCCCNC(=O)C(=O)N(CCCCN=C(N[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4209.2	Semi standard non polar	33892256
Bis(agmatine)oxalamide,4TBDMS,isomer #4	CC(C)(C)[Si](C)(C)NC(N)=NCCCCNC(=O)C(=O)N(CCCCN=C(N[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3207.1	Standard non polar	33892256
Bis(agmatine)oxalamide,4TBDMS,isomer #4	CC(C)(C)[Si](C)(C)NC(N)=NCCCCNC(=O)C(=O)N(CCCCN=C(N[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	5765.4	Standard polar	33892256
Bis(agmatine)oxalamide,4TBDMS,isomer #5	CC(C)(C)[Si](C)(C)NC(N)=NCCCCNC(=O)C(=O)NCCCCN=C(N[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4276.6	Semi standard non polar	33892256
Bis(agmatine)oxalamide,4TBDMS,isomer #5	CC(C)(C)[Si](C)(C)NC(N)=NCCCCNC(=O)C(=O)NCCCCN=C(N[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3283.1	Standard non polar	33892256
Bis(agmatine)oxalamide,4TBDMS,isomer #5	CC(C)(C)[Si](C)(C)NC(N)=NCCCCNC(=O)C(=O)NCCCCN=C(N[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	5751.1	Standard polar	33892256
Bis(agmatine)oxalamide,4TBDMS,isomer #6	CC(C)(C)[Si](C)(C)N(C(=NCCCCNC(=O)C(=O)NCCCCN=C(N)N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4161.1	Semi standard non polar	33892256
Bis(agmatine)oxalamide,4TBDMS,isomer #6	CC(C)(C)[Si](C)(C)N(C(=NCCCCNC(=O)C(=O)NCCCCN=C(N)N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3531.0	Standard non polar	33892256
Bis(agmatine)oxalamide,4TBDMS,isomer #6	CC(C)(C)[Si](C)(C)N(C(=NCCCCNC(=O)C(=O)NCCCCN=C(N)N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	5837.2	Standard polar	33892256
Bis(agmatine)oxalamide,4TBDMS,isomer #7	CC(C)(C)[Si](C)(C)NC(=NCCCCN(C(=O)C(=O)NCCCCN=C(N)N)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4074.6	Semi standard non polar	33892256
Bis(agmatine)oxalamide,4TBDMS,isomer #7	CC(C)(C)[Si](C)(C)NC(=NCCCCN(C(=O)C(=O)NCCCCN=C(N)N)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3465.9	Standard non polar	33892256
Bis(agmatine)oxalamide,4TBDMS,isomer #7	CC(C)(C)[Si](C)(C)NC(=NCCCCN(C(=O)C(=O)NCCCCN=C(N)N)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	5828.7	Standard polar	33892256
Bis(agmatine)oxalamide,4TBDMS,isomer #8	CC(C)(C)[Si](C)(C)NC(=NCCCCNC(=O)C(=O)N(CCCCN=C(N)N)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4076.9	Semi standard non polar	33892256
Bis(agmatine)oxalamide,4TBDMS,isomer #8	CC(C)(C)[Si](C)(C)NC(=NCCCCNC(=O)C(=O)N(CCCCN=C(N)N)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3466.7	Standard non polar	33892256
Bis(agmatine)oxalamide,4TBDMS,isomer #8	CC(C)(C)[Si](C)(C)NC(=NCCCCNC(=O)C(=O)N(CCCCN=C(N)N)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	5828.6	Standard polar	33892256
Bis(agmatine)oxalamide,4TBDMS,isomer #9	CC(C)(C)[Si](C)(C)NC(=NCCCCN(C(=O)C(=O)N(CCCCN=C(N)N)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C	4051.5	Semi standard non polar	33892256
Bis(agmatine)oxalamide,4TBDMS,isomer #9	CC(C)(C)[Si](C)(C)NC(=NCCCCN(C(=O)C(=O)N(CCCCN=C(N)N)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C	3306.8	Standard non polar	33892256
Bis(agmatine)oxalamide,4TBDMS,isomer #9	CC(C)(C)[Si](C)(C)NC(=NCCCCN(C(=O)C(=O)N(CCCCN=C(N)N)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C	5875.0	Standard polar	33892256
Bis(agmatine)oxalamide,5TBDMS,isomer #1	CC(C)(C)[Si](C)(C)NC(=NCCCCNC(=O)C(=O)NCCCCN=C(N[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C	4514.2	Semi standard non polar	33892256
Bis(agmatine)oxalamide,5TBDMS,isomer #1	CC(C)(C)[Si](C)(C)NC(=NCCCCNC(=O)C(=O)NCCCCN=C(N[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C	3361.6	Standard non polar	33892256
Bis(agmatine)oxalamide,5TBDMS,isomer #1	CC(C)(C)[Si](C)(C)NC(=NCCCCNC(=O)C(=O)NCCCCN=C(N[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C	5093.4	Standard polar	33892256
Bis(agmatine)oxalamide,5TBDMS,isomer #10	CC(C)(C)[Si](C)(C)N(CCCCN=C(N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)C(=O)NCCCCN=C(N)N	4228.3	Semi standard non polar	33892256
Bis(agmatine)oxalamide,5TBDMS,isomer #10	CC(C)(C)[Si](C)(C)N(CCCCN=C(N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)C(=O)NCCCCN=C(N)N	3717.2	Standard non polar	33892256
Bis(agmatine)oxalamide,5TBDMS,isomer #10	CC(C)(C)[Si](C)(C)N(CCCCN=C(N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)C(=O)NCCCCN=C(N)N	5628.6	Standard polar	33892256
Bis(agmatine)oxalamide,5TBDMS,isomer #11	CC(C)(C)[Si](C)(C)N(CCCCN=C(N)N)C(=O)C(=O)NCCCCN=C(N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4227.3	Semi standard non polar	33892256
Bis(agmatine)oxalamide,5TBDMS,isomer #11	CC(C)(C)[Si](C)(C)N(CCCCN=C(N)N)C(=O)C(=O)NCCCCN=C(N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3718.8	Standard non polar	33892256
Bis(agmatine)oxalamide,5TBDMS,isomer #11	CC(C)(C)[Si](C)(C)N(CCCCN=C(N)N)C(=O)C(=O)NCCCCN=C(N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	5628.9	Standard polar	33892256
Bis(agmatine)oxalamide,5TBDMS,isomer #12	CC(C)(C)[Si](C)(C)NC(=NCCCCN(C(=O)C(=O)N(CCCCN=C(N)N)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4171.0	Semi standard non polar	33892256
Bis(agmatine)oxalamide,5TBDMS,isomer #12	CC(C)(C)[Si](C)(C)NC(=NCCCCN(C(=O)C(=O)N(CCCCN=C(N)N)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3631.2	Standard non polar	33892256
Bis(agmatine)oxalamide,5TBDMS,isomer #12	CC(C)(C)[Si](C)(C)NC(=NCCCCN(C(=O)C(=O)N(CCCCN=C(N)N)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	5686.8	Standard polar	33892256
Bis(agmatine)oxalamide,5TBDMS,isomer #13	CC(C)(C)[Si](C)(C)N(CCCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)C(=O)NCCCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4296.7	Semi standard non polar	33892256
Bis(agmatine)oxalamide,5TBDMS,isomer #13	CC(C)(C)[Si](C)(C)N(CCCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)C(=O)NCCCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3625.1	Standard non polar	33892256
Bis(agmatine)oxalamide,5TBDMS,isomer #13	CC(C)(C)[Si](C)(C)N(CCCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)C(=O)NCCCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	6020.3	Standard polar	33892256
Bis(agmatine)oxalamide,5TBDMS,isomer #14	CC(C)(C)[Si](C)(C)NC(N)=NCCCCN(C(=O)C(=O)N(CCCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4205.0	Semi standard non polar	33892256
Bis(agmatine)oxalamide,5TBDMS,isomer #14	CC(C)(C)[Si](C)(C)NC(N)=NCCCCN(C(=O)C(=O)N(CCCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3580.7	Standard non polar	33892256
Bis(agmatine)oxalamide,5TBDMS,isomer #14	CC(C)(C)[Si](C)(C)NC(N)=NCCCCN(C(=O)C(=O)N(CCCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	6016.7	Standard polar	33892256
Bis(agmatine)oxalamide,5TBDMS,isomer #2	CC(C)(C)[Si](C)(C)NC(=NCCCCNC(=O)C(=O)N(CCCCN=C(N[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C	4461.4	Semi standard non polar	33892256
Bis(agmatine)oxalamide,5TBDMS,isomer #2	CC(C)(C)[Si](C)(C)NC(=NCCCCNC(=O)C(=O)N(CCCCN=C(N[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C	3301.1	Standard non polar	33892256
Bis(agmatine)oxalamide,5TBDMS,isomer #2	CC(C)(C)[Si](C)(C)NC(=NCCCCNC(=O)C(=O)N(CCCCN=C(N[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C	5112.3	Standard polar	33892256
Bis(agmatine)oxalamide,5TBDMS,isomer #3	CC(C)(C)[Si](C)(C)NC(=NCCCCNC(=O)C(=O)NCCCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4434.6	Semi standard non polar	33892256
Bis(agmatine)oxalamide,5TBDMS,isomer #3	CC(C)(C)[Si](C)(C)NC(=NCCCCNC(=O)C(=O)NCCCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3508.0	Standard non polar	33892256
Bis(agmatine)oxalamide,5TBDMS,isomer #3	CC(C)(C)[Si](C)(C)NC(=NCCCCNC(=O)C(=O)NCCCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	5543.6	Standard polar	33892256
Bis(agmatine)oxalamide,5TBDMS,isomer #4	CC(C)(C)[Si](C)(C)NC(=NCCCCN(C(=O)C(=O)NCCCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C	4357.0	Semi standard non polar	33892256
Bis(agmatine)oxalamide,5TBDMS,isomer #4	CC(C)(C)[Si](C)(C)NC(=NCCCCN(C(=O)C(=O)NCCCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C	3455.8	Standard non polar	33892256
Bis(agmatine)oxalamide,5TBDMS,isomer #4	CC(C)(C)[Si](C)(C)NC(=NCCCCN(C(=O)C(=O)NCCCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C	5557.7	Standard polar	33892256
Bis(agmatine)oxalamide,5TBDMS,isomer #5	CC(C)(C)[Si](C)(C)NC(=NCCCCNC(=O)C(=O)N(CCCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C	4360.9	Semi standard non polar	33892256
Bis(agmatine)oxalamide,5TBDMS,isomer #5	CC(C)(C)[Si](C)(C)NC(=NCCCCNC(=O)C(=O)N(CCCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C	3455.1	Standard non polar	33892256
Bis(agmatine)oxalamide,5TBDMS,isomer #5	CC(C)(C)[Si](C)(C)NC(=NCCCCNC(=O)C(=O)N(CCCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C	5557.8	Standard polar	33892256
Bis(agmatine)oxalamide,5TBDMS,isomer #6	CC(C)(C)[Si](C)(C)NC(N)=NCCCCN(C(=O)C(=O)N(CCCCN=C(N[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4281.9	Semi standard non polar	33892256
Bis(agmatine)oxalamide,5TBDMS,isomer #6	CC(C)(C)[Si](C)(C)NC(N)=NCCCCN(C(=O)C(=O)N(CCCCN=C(N[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3385.5	Standard non polar	33892256
Bis(agmatine)oxalamide,5TBDMS,isomer #6	CC(C)(C)[Si](C)(C)NC(N)=NCCCCN(C(=O)C(=O)N(CCCCN=C(N[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	5548.3	Standard polar	33892256
Bis(agmatine)oxalamide,5TBDMS,isomer #7	CC(C)(C)[Si](C)(C)NC(N)=NCCCCN(C(=O)C(=O)NCCCCN=C(N[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4308.9	Semi standard non polar	33892256
Bis(agmatine)oxalamide,5TBDMS,isomer #7	CC(C)(C)[Si](C)(C)NC(N)=NCCCCN(C(=O)C(=O)NCCCCN=C(N[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3500.6	Standard non polar	33892256
Bis(agmatine)oxalamide,5TBDMS,isomer #7	CC(C)(C)[Si](C)(C)NC(N)=NCCCCN(C(=O)C(=O)NCCCCN=C(N[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	5491.9	Standard polar	33892256
Bis(agmatine)oxalamide,5TBDMS,isomer #8	CC(C)(C)[Si](C)(C)NC(N)=NCCCCNC(=O)C(=O)N(CCCCN=C(N[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4308.5	Semi standard non polar	33892256
Bis(agmatine)oxalamide,5TBDMS,isomer #8	CC(C)(C)[Si](C)(C)NC(N)=NCCCCNC(=O)C(=O)N(CCCCN=C(N[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3501.1	Standard non polar	33892256
Bis(agmatine)oxalamide,5TBDMS,isomer #8	CC(C)(C)[Si](C)(C)NC(N)=NCCCCNC(=O)C(=O)N(CCCCN=C(N[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	5491.7	Standard polar	33892256
Bis(agmatine)oxalamide,5TBDMS,isomer #9	CC(C)(C)[Si](C)(C)NC(N)=NCCCCNC(=O)C(=O)NCCCCN=C(N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4398.2	Semi standard non polar	33892256
Bis(agmatine)oxalamide,5TBDMS,isomer #9	CC(C)(C)[Si](C)(C)NC(N)=NCCCCNC(=O)C(=O)NCCCCN=C(N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3537.6	Standard non polar	33892256
Bis(agmatine)oxalamide,5TBDMS,isomer #9	CC(C)(C)[Si](C)(C)NC(N)=NCCCCNC(=O)C(=O)NCCCCN=C(N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	5476.6	Standard polar	33892256

Spectra

GC-MS Spectra

Spectrum Type	Description	Splash Key	Deposition Date	Source	View
Predicted GC-MS	Predicted GC-MS Spectrum - Bis(agmatine)oxalamide GC-MS (Non-derivatized) - 70eV, Positive	splash10-0btl-5950000000-52ee8225cff77b2eb49a	2021-09-24	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Bis(agmatine)oxalamide GC-MS (Non-derivatized) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum

MS/MS Spectra

Spectrum Type	Description	Splash Key	Deposition Date	Source	View
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Bis(agmatine)oxalamide 10V, Positive-QTOF	splash10-014i-0009000000-2e0b40f4f5e7ae515e7b	2021-10-12	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Bis(agmatine)oxalamide 20V, Positive-QTOF	splash10-0pvj-0292000000-3df890818477cbe51aa7	2021-10-12	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Bis(agmatine)oxalamide 40V, Positive-QTOF	splash10-01x0-7910000000-e5b9dec4a43ce8cf82c4	2021-10-12	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Bis(agmatine)oxalamide 10V, Negative-QTOF	splash10-03di-0039000000-ba294bed9b8591987417	2021-10-12	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Bis(agmatine)oxalamide 20V, Negative-QTOF	splash10-03kc-5295000000-77ba2003cbc959c4fb1a	2021-10-12	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Bis(agmatine)oxalamide 40V, Negative-QTOF	splash10-0a6r-1940000000-7a52d344145b8130d0a9	2021-10-12	Wishart Lab	View Spectrum

NMR Spectra

Spectrum Type	Description	Deposition Date	Source	View
Predicted 1D NMR	¹H NMR Spectrum (1D, 100 MHz, D₂O, predicted)	2021-10-13	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 100 MHz, D₂O, predicted)	2021-10-13	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 1000 MHz, D₂O, predicted)	2021-10-13	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 1000 MHz, D₂O, predicted)	2021-10-13	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 200 MHz, D₂O, predicted)	2021-10-13	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 200 MHz, D₂O, predicted)	2021-10-13	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 300 MHz, D₂O, predicted)	2021-10-13	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 300 MHz, D₂O, predicted)	2021-10-13	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 400 MHz, D₂O, predicted)	2021-10-13	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 400 MHz, D₂O, predicted)	2021-10-13	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 500 MHz, D₂O, predicted)	2021-10-13	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 500 MHz, D₂O, predicted)	2021-10-13	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 600 MHz, D₂O, predicted)	2021-10-13	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 600 MHz, D₂O, predicted)	2021-10-13	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 700 MHz, D₂O, predicted)	2021-10-13	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 700 MHz, D₂O, predicted)	2021-10-13	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 800 MHz, D₂O, predicted)	2021-10-13	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 800 MHz, D₂O, predicted)	2021-10-13	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 900 MHz, D₂O, predicted)	2021-10-13	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 900 MHz, D₂O, predicted)	2021-10-13	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

2291496

KEGG Compound ID

Not Available

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Not Available

METLIN ID

Not Available

PubChem Compound

Not Available

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 Bis(agmatine)oxalamide (HMDB0249255)

MOL for HMDB0249255 (Bis(agmatine)oxalamide)

3D MOL for HMDB0249255 (Bis(agmatine)oxalamide)

3D SDF for HMDB0249255 (Bis(agmatine)oxalamide)

3D-SDF for HMDB0249255 (Bis(agmatine)oxalamide)

PDB for HMDB0249255 (Bis(agmatine)oxalamide)

3D PDB for HMDB0249255 (Bis(agmatine)oxalamide)

SMILES for HMDB0249255 (Bis(agmatine)oxalamide)

INCHI for HMDB0249255 (Bis(agmatine)oxalamide)

Structure for HMDB0249255 (Bis(agmatine)oxalamide)

3D Structure for HMDB0249255 (Bis(agmatine)oxalamide)

Predicted Collision Cross Sections

Predicted Kovats Retention Indices

Underivatized

Derivatized

GC-MS Spectra

MS/MS Spectra

NMR Spectra