Hmdb loader

Showing metabocard for Dalamid (HMDB0250832)

Jump To Section:
IdentificationTaxonomyOntologyPhysical propertiesSpectraBiological propertiesConcentrationsLinksReferencesXML
Record Information
Version5.0
StatusDetected but not Quantified
Creation Date2021-09-11 07:56:27 UTC
Update Date2021-09-26 23:02:31 UTC
HMDB IDHMDB0250832
Secondary Accession NumbersNone
Metabolite Identification
Common NameDalamid
DescriptionDalamid, also known as DALA or D-enkephalin, belongs to the class of organic compounds known as oligopeptides. These are organic compounds containing a sequence of between three and ten alpha-amino acids joined by peptide bonds. Based on a literature review very few articles have been published on Dalamid. This compound has been identified in human blood as reported by (PMID: 31557052 ). Dalamid is not a naturally occurring metabolite and is only found in those individuals exposed to this compound or its derivatives. Technically Dalamid 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
Thumb
MOL3D MOLSDF3D SDFPDB3D PDBSMILESInChI

MOL for HMDB0250832 (Dalamid)


  Mrv1652309112109562D          

 41 42  0  0  0  0            999 V2000
   15.0039  -10.3125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.0039  -11.1375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2894  -11.5500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2894  -12.3750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.5749  -11.1375    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.8605  -11.5500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1460  -11.1375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1460  -10.3125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.4315  -11.5500    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.7171  -11.1375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7171  -10.3125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0026   -9.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2881  -10.3125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5737   -9.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5737   -9.0750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2881   -8.6625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0026   -9.0750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0026  -11.5500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0026  -12.3750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.2881  -11.1375    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.5737  -11.5500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8592  -11.1375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1447  -11.5500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4302  -11.1375    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    5.7158  -11.5500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5737  -12.3750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8592  -12.7875    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.2881  -12.7875    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   15.7184  -11.5500    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   16.4328  -11.1375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.4328  -10.3125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.1473  -11.5500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.8618  -11.1375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.5762  -11.5500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.2907  -11.1375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.0052  -11.5500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.0052  -12.3750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.2907  -12.7875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.5762  -12.3750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.7197  -12.7875    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.1473  -12.3750    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  2  0  0  0  0
  3  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  2  0  0  0  0
  7  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  2  0  0  0  0
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
 15 16  1  0  0  0  0
 16 17  2  0  0  0  0
 12 17  1  0  0  0  0
 10 18  1  0  0  0  0
 18 19  2  0  0  0  0
 18 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 21 26  1  0  0  0  0
 26 27  2  0  0  0  0
 26 28  1  0  0  0  0
  2 29  1  0  0  0  0
 29 30  1  0  0  0  0
 30 31  2  0  0  0  0
 30 32  1  0  0  0  0
 32 33  1  0  0  0  0
 33 34  1  0  0  0  0
 34 35  2  0  0  0  0
 35 36  1  0  0  0  0
 36 37  2  0  0  0  0
 37 38  1  0  0  0  0
 38 39  2  0  0  0  0
 34 39  1  0  0  0  0
 37 40  1  0  0  0  0
 32 41  1  0  0  0  0
M  END
Download

3D MOL for HMDB0250832 (Dalamid)

HMDB0250832
     RDKit          3D
Dalamid
 79 80  0  0  0  0  0  0  0  0999 V2000
   -3.5139    5.5620    1.3295 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0591    5.2405    0.4117 S   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0016    4.0226    1.3635 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3529    2.6782    1.4151 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1512    2.0297    0.0770 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5138    0.7323    0.2507 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3216    0.3470   -0.4017 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7851    1.1576   -1.1667 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7152   -1.0097   -0.1791 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7786   -2.0089   -0.4739 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3659   -3.4222   -0.3056 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5359   -4.0472    0.9307 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1713   -5.3558    1.1409 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6170   -6.1206    0.1393 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4499   -5.5004   -1.0815 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8127   -4.1790   -1.3125 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5424   -1.1926   -1.0028 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5580   -1.0276   -2.3977 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6623   -0.7122   -2.9542 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4225   -1.1844   -3.3192 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7868   -1.4819   -2.5943 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.3183   -0.5359   -1.6938 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7524    0.5911   -1.5180 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5568   -0.8550   -0.9383 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3259   -2.1097   -0.1159 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9741    0.2524   -0.1000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.2936    0.7443   -0.0737 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1609    0.1962   -0.8016 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.6770    1.8644    0.7680 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4457    2.4200    1.3631 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.6487    1.5069    1.8756 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9039    0.9272    1.3773 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0091    1.6514    0.9823 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1591    1.0271    0.5403 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2790   -0.3505    0.4645 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4290   -0.9951    0.0221 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.1580   -1.0773    0.8656 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0130   -0.4701    1.3050 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4356    1.8218   -0.6611 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.2547    2.9212   -0.9761 N   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8342    0.6844   -1.0257 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6770    4.9519    0.9784 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2817    6.6566    1.2496 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6755    5.3606    2.4223 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9924    4.3986    2.4367 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0776    4.0071    1.1061 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3581    2.7952    1.8966 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9625    2.0481    2.1047 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5058    2.6688   -0.5455 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9672    0.0548    0.8950 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3853   -1.0095    0.8933 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7251   -1.7961    0.0961 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0913   -1.8984   -1.5444 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9663   -3.4556    1.7109 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3042   -5.8514    2.1140 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3259   -7.1487    0.2864 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0134   -6.0543   -1.9225 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6700   -3.7145   -2.2885 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6333   -1.4760   -0.5495 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5811   -1.9812   -4.0760 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2847   -0.1998   -3.8455 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2885   -2.4074   -2.7273 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4042   -1.0937   -1.6072 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0454   -2.9624   -0.7592 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1788   -2.3523    0.5247 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4653   -1.8596    0.5658 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2567    0.6947    0.5045 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1399    2.7163    0.2121 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7523    2.6688    0.6562 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1622    1.7693    2.1070 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.8818    2.3854    2.5122 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1541    0.7635    2.5317 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.9433    2.7509    1.0294 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.0072    1.6473    0.2386 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.4802   -1.1869   -0.9826 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.2517   -2.1698    0.8072 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.1548   -1.0884    1.6095 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8656    3.7470   -1.4453 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.2577    2.8790   -0.7242 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  2  0
  7  9  1  0
  9 10  1  0
 10 11  1  0
 11 12  2  0
 12 13  1  0
 13 14  2  0
 14 15  1  0
 15 16  2  0
  9 17  1  0
 17 18  1  0
 18 19  2  0
 18 20  1  0
 20 21  1  0
 21 22  1  0
 22 23  2  0
 22 24  1  0
 24 25  1  0
 24 26  1  0
 26 27  1  0
 27 28  2  0
 27 29  1  0
 29 30  1  0
 29 31  1  0
 31 32  1  0
 32 33  2  0
 33 34  1  0
 34 35  2  0
 35 36  1  0
 35 37  1  0
 37 38  2  0
  5 39  1  0
 39 40  1  0
 39 41  2  0
 16 11  1  0
 38 32  1  0
  1 42  1  0
  1 43  1  0
  1 44  1  0
  3 45  1  0
  3 46  1  0
  4 47  1  0
  4 48  1  0
  5 49  1  0
  6 50  1  0
  9 51  1  0
 10 52  1  0
 10 53  1  0
 12 54  1  0
 13 55  1  0
 14 56  1  0
 15 57  1  0
 16 58  1  0
 17 59  1  0
 20 60  1  0
 20 61  1  0
 21 62  1  0
 24 63  1  0
 25 64  1  0
 25 65  1  0
 25 66  1  0
 26 67  1  0
 29 68  1  0
 30 69  1  0
 30 70  1  0
 31 71  1  0
 31 72  1  0
 33 73  1  0
 34 74  1  0
 36 75  1  0
 37 76  1  0
 38 77  1  0
 40 78  1  0
 40 79  1  0
M  END
Download

3D SDF for HMDB0250832 (Dalamid)


  Mrv1652309112109562D          

 41 42  0  0  0  0            999 V2000
   15.0039  -10.3125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.0039  -11.1375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2894  -11.5500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2894  -12.3750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.5749  -11.1375    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.8605  -11.5500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1460  -11.1375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1460  -10.3125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.4315  -11.5500    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.7171  -11.1375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7171  -10.3125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0026   -9.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2881  -10.3125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5737   -9.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5737   -9.0750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2881   -8.6625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0026   -9.0750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0026  -11.5500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0026  -12.3750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.2881  -11.1375    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.5737  -11.5500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8592  -11.1375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1447  -11.5500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4302  -11.1375    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    5.7158  -11.5500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5737  -12.3750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8592  -12.7875    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.2881  -12.7875    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   15.7184  -11.5500    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   16.4328  -11.1375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.4328  -10.3125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.1473  -11.5500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.8618  -11.1375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.5762  -11.5500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.2907  -11.1375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.0052  -11.5500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.0052  -12.3750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.2907  -12.7875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.5762  -12.3750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.7197  -12.7875    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.1473  -12.3750    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  2  0  0  0  0
  3  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  2  0  0  0  0
  7  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  2  0  0  0  0
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
 15 16  1  0  0  0  0
 16 17  2  0  0  0  0
 12 17  1  0  0  0  0
 10 18  1  0  0  0  0
 18 19  2  0  0  0  0
 18 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 21 26  1  0  0  0  0
 26 27  2  0  0  0  0
 26 28  1  0  0  0  0
  2 29  1  0  0  0  0
 29 30  1  0  0  0  0
 30 31  2  0  0  0  0
 30 32  1  0  0  0  0
 32 33  1  0  0  0  0
 33 34  1  0  0  0  0
 34 35  2  0  0  0  0
 35 36  1  0  0  0  0
 36 37  2  0  0  0  0
 37 38  1  0  0  0  0
 38 39  2  0  0  0  0
 34 39  1  0  0  0  0
 37 40  1  0  0  0  0
 32 41  1  0  0  0  0
M  END
> <DATABASE_ID>
HMDB0250832

> <DATABASE_NAME>
hmdb

> <SMILES>
CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)C(N)=O

> <INCHI_IDENTIFIER>
InChI=1S/C28H38N6O6S/c1-17(32-27(39)21(29)14-19-8-10-20(35)11-9-19)26(38)31-16-24(36)33-23(15-18-6-4-3-5-7-18)28(40)34-22(25(30)37)12-13-41-2/h3-11,17,21-23,35H,12-16,29H2,1-2H3,(H2,30,37)(H,31,38)(H,32,39)(H,33,36)(H,34,40)

> <INCHI_KEY>
ANZXICRKKYOVMY-UHFFFAOYSA-N

> <FORMULA>
C28H38N6O6S

> <MOLECULAR_WEIGHT>
586.71

> <EXACT_MASS>
586.257354142

> <JCHEM_ACCEPTOR_COUNT>
7

> <JCHEM_ATOM_COUNT>
79

> <JCHEM_AVERAGE_POLARIZABILITY>
61.844288844984284

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
7

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
2-[2-(2-{2-[2-amino-3-(4-hydroxyphenyl)propanamido]propanamido}acetamido)-3-phenylpropanamido]-4-(methylsulfanyl)butanamide

> <ALOGPS_LOGP>
0.37

> <JCHEM_LOGP>
-0.580327824175246

> <ALOGPS_LOGS>
-4.69

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
2

> <JCHEM_PHYSIOLOGICAL_CHARGE>
1

> <JCHEM_PKA>
11.926971524102754

> <JCHEM_PKA_STRONGEST_ACIDIC>
9.50932670886562

> <JCHEM_PKA_STRONGEST_BASIC>
7.726990702741314

> <JCHEM_POLAR_SURFACE_AREA>
205.74

> <JCHEM_REFRACTIVITY>
155.32279999999994

> <JCHEM_ROTATABLE_BOND_COUNT>
16

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
1.20e-02 g/l

> <JCHEM_TRADITIONAL_IUPAC>
2-[2-(2-{2-[2-amino-3-(4-hydroxyphenyl)propanamido]propanamido}acetamido)-3-phenylpropanamido]-4-(methylsulfanyl)butanamide

> <JCHEM_VEBER_RULE>
0

$$$$
Download

3D-SDF for HMDB0250832 (Dalamid)

HMDB0250832
     RDKit          3D
Dalamid
 79 80  0  0  0  0  0  0  0  0999 V2000
   -3.5139    5.5620    1.3295 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0591    5.2405    0.4117 S   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0016    4.0226    1.3635 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3529    2.6782    1.4151 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1512    2.0297    0.0770 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5138    0.7323    0.2507 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3216    0.3470   -0.4017 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7851    1.1576   -1.1667 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7152   -1.0097   -0.1791 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7786   -2.0089   -0.4739 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3659   -3.4222   -0.3056 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5359   -4.0472    0.9307 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1713   -5.3558    1.1409 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6170   -6.1206    0.1393 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4499   -5.5004   -1.0815 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8127   -4.1790   -1.3125 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5424   -1.1926   -1.0028 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5580   -1.0276   -2.3977 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6623   -0.7122   -2.9542 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4225   -1.1844   -3.3192 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7868   -1.4819   -2.5943 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.3183   -0.5359   -1.6938 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7524    0.5911   -1.5180 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5568   -0.8550   -0.9383 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3259   -2.1097   -0.1159 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9741    0.2524   -0.1000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.2936    0.7443   -0.0737 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1609    0.1962   -0.8016 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.6770    1.8644    0.7680 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4457    2.4200    1.3631 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.6487    1.5069    1.8756 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9039    0.9272    1.3773 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0091    1.6514    0.9823 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1591    1.0271    0.5403 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2790   -0.3505    0.4645 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4290   -0.9951    0.0221 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.1580   -1.0773    0.8656 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0130   -0.4701    1.3050 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4356    1.8218   -0.6611 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.2547    2.9212   -0.9761 N   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8342    0.6844   -1.0257 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6770    4.9519    0.9784 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2817    6.6566    1.2496 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6755    5.3606    2.4223 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9924    4.3986    2.4367 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0776    4.0071    1.1061 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3581    2.7952    1.8966 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9625    2.0481    2.1047 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5058    2.6688   -0.5455 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9672    0.0548    0.8950 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3853   -1.0095    0.8933 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7251   -1.7961    0.0961 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0913   -1.8984   -1.5444 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9663   -3.4556    1.7109 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3042   -5.8514    2.1140 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3259   -7.1487    0.2864 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0134   -6.0543   -1.9225 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6700   -3.7145   -2.2885 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6333   -1.4760   -0.5495 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5811   -1.9812   -4.0760 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2847   -0.1998   -3.8455 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2885   -2.4074   -2.7273 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4042   -1.0937   -1.6072 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0454   -2.9624   -0.7592 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1788   -2.3523    0.5247 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4653   -1.8596    0.5658 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2567    0.6947    0.5045 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1399    2.7163    0.2121 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7523    2.6688    0.6562 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1622    1.7693    2.1070 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.8818    2.3854    2.5122 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1541    0.7635    2.5317 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.9433    2.7509    1.0294 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.0072    1.6473    0.2386 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.4802   -1.1869   -0.9826 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.2517   -2.1698    0.8072 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.1548   -1.0884    1.6095 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8656    3.7470   -1.4453 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.2577    2.8790   -0.7242 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  2  0
  7  9  1  0
  9 10  1  0
 10 11  1  0
 11 12  2  0
 12 13  1  0
 13 14  2  0
 14 15  1  0
 15 16  2  0
  9 17  1  0
 17 18  1  0
 18 19  2  0
 18 20  1  0
 20 21  1  0
 21 22  1  0
 22 23  2  0
 22 24  1  0
 24 25  1  0
 24 26  1  0
 26 27  1  0
 27 28  2  0
 27 29  1  0
 29 30  1  0
 29 31  1  0
 31 32  1  0
 32 33  2  0
 33 34  1  0
 34 35  2  0
 35 36  1  0
 35 37  1  0
 37 38  2  0
  5 39  1  0
 39 40  1  0
 39 41  2  0
 16 11  1  0
 38 32  1  0
  1 42  1  0
  1 43  1  0
  1 44  1  0
  3 45  1  0
  3 46  1  0
  4 47  1  0
  4 48  1  0
  5 49  1  0
  6 50  1  0
  9 51  1  0
 10 52  1  0
 10 53  1  0
 12 54  1  0
 13 55  1  0
 14 56  1  0
 15 57  1  0
 16 58  1  0
 17 59  1  0
 20 60  1  0
 20 61  1  0
 21 62  1  0
 24 63  1  0
 25 64  1  0
 25 65  1  0
 25 66  1  0
 26 67  1  0
 29 68  1  0
 30 69  1  0
 30 70  1  0
 31 71  1  0
 31 72  1  0
 33 73  1  0
 34 74  1  0
 36 75  1  0
 37 76  1  0
 38 77  1  0
 40 78  1  0
 40 79  1  0
M  END
Download

PDB for HMDB0250832 (Dalamid)

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      28.007 -19.250   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0      28.007 -20.790   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0      26.674 -21.560   0.000  0.00  0.00           C+0
HETATM    4  O   UNK     0      26.674 -23.100   0.000  0.00  0.00           O+0
HETATM    5  N   UNK     0      25.340 -20.790   0.000  0.00  0.00           N+0
HETATM    6  C   UNK     0      24.006 -21.560   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0      22.673 -20.790   0.000  0.00  0.00           C+0
HETATM    8  O   UNK     0      22.673 -19.250   0.000  0.00  0.00           O+0
HETATM    9  N   UNK     0      21.339 -21.560   0.000  0.00  0.00           N+0
HETATM   10  C   UNK     0      20.005 -20.790   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0      20.005 -19.250   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0      18.672 -18.480   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0      17.338 -19.250   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0      16.004 -18.480   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0      16.004 -16.940   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0      17.338 -16.170   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0      18.672 -16.940   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0      18.672 -21.560   0.000  0.00  0.00           C+0
HETATM   19  O   UNK     0      18.672 -23.100   0.000  0.00  0.00           O+0
HETATM   20  N   UNK     0      17.338 -20.790   0.000  0.00  0.00           N+0
HETATM   21  C   UNK     0      16.004 -21.560   0.000  0.00  0.00           C+0
HETATM   22  C   UNK     0      14.670 -20.790   0.000  0.00  0.00           C+0
HETATM   23  C   UNK     0      13.337 -21.560   0.000  0.00  0.00           C+0
HETATM   24  S   UNK     0      12.003 -20.790   0.000  0.00  0.00           S+0
HETATM   25  C   UNK     0      10.669 -21.560   0.000  0.00  0.00           C+0
HETATM   26  C   UNK     0      16.004 -23.100   0.000  0.00  0.00           C+0
HETATM   27  O   UNK     0      14.670 -23.870   0.000  0.00  0.00           O+0
HETATM   28  N   UNK     0      17.338 -23.870   0.000  0.00  0.00           N+0
HETATM   29  N   UNK     0      29.341 -21.560   0.000  0.00  0.00           N+0
HETATM   30  C   UNK     0      30.675 -20.790   0.000  0.00  0.00           C+0
HETATM   31  O   UNK     0      30.675 -19.250   0.000  0.00  0.00           O+0
HETATM   32  C   UNK     0      32.008 -21.560   0.000  0.00  0.00           C+0
HETATM   33  C   UNK     0      33.342 -20.790   0.000  0.00  0.00           C+0
HETATM   34  C   UNK     0      34.676 -21.560   0.000  0.00  0.00           C+0
HETATM   35  C   UNK     0      36.009 -20.790   0.000  0.00  0.00           C+0
HETATM   36  C   UNK     0      37.343 -21.560   0.000  0.00  0.00           C+0
HETATM   37  C   UNK     0      37.343 -23.100   0.000  0.00  0.00           C+0
HETATM   38  C   UNK     0      36.009 -23.870   0.000  0.00  0.00           C+0
HETATM   39  C   UNK     0      34.676 -23.100   0.000  0.00  0.00           C+0
HETATM   40  O   UNK     0      38.677 -23.870   0.000  0.00  0.00           O+0
HETATM   41  N   UNK     0      32.008 -23.100   0.000  0.00  0.00           N+0
CONECT    1    2                                                            
CONECT    2    1    3   29                                                  
CONECT    3    2    4    5                                                  
CONECT    4    3                                                            
CONECT    5    3    6                                                       
CONECT    6    5    7                                                       
CONECT    7    6    8    9                                                  
CONECT    8    7                                                            
CONECT    9    7   10                                                       
CONECT   10    9   11   18                                                  
CONECT   11   10   12                                                       
CONECT   12   11   13   17                                                  
CONECT   13   12   14                                                       
CONECT   14   13   15                                                       
CONECT   15   14   16                                                       
CONECT   16   15   17                                                       
CONECT   17   16   12                                                       
CONECT   18   10   19   20                                                  
CONECT   19   18                                                            
CONECT   20   18   21                                                       
CONECT   21   20   22   26                                                  
CONECT   22   21   23                                                       
CONECT   23   22   24                                                       
CONECT   24   23   25                                                       
CONECT   25   24                                                            
CONECT   26   21   27   28                                                  
CONECT   27   26                                                            
CONECT   28   26                                                            
CONECT   29    2   30                                                       
CONECT   30   29   31   32                                                  
CONECT   31   30                                                            
CONECT   32   30   33   41                                                  
CONECT   33   32   34                                                       
CONECT   34   33   35   39                                                  
CONECT   35   34   36                                                       
CONECT   36   35   37                                                       
CONECT   37   36   38   40                                                  
CONECT   38   37   39                                                       
CONECT   39   38   34                                                       
CONECT   40   37                                                            
CONECT   41   32                                                            
MASTER        0    0    0    0    0    0    0    0   41    0   84    0
END
Download

3D PDB for HMDB0250832 (Dalamid)

COMPND    HMDB0250832
HETATM    1  C1  UNL     1      -3.514   5.562   1.330  1.00  0.00           C  
HETATM    2  S1  UNL     1      -5.059   5.240   0.412  1.00  0.00           S  
HETATM    3  C2  UNL     1      -6.002   4.023   1.363  1.00  0.00           C  
HETATM    4  C3  UNL     1      -5.353   2.678   1.415  1.00  0.00           C  
HETATM    5  C4  UNL     1      -5.151   2.030   0.077  1.00  0.00           C  
HETATM    6  N1  UNL     1      -4.514   0.732   0.251  1.00  0.00           N  
HETATM    7  C5  UNL     1      -3.322   0.347  -0.402  1.00  0.00           C  
HETATM    8  O1  UNL     1      -2.785   1.158  -1.167  1.00  0.00           O  
HETATM    9  C6  UNL     1      -2.715  -1.010  -0.179  1.00  0.00           C  
HETATM   10  C7  UNL     1      -3.779  -2.009  -0.474  1.00  0.00           C  
HETATM   11  C8  UNL     1      -3.366  -3.422  -0.306  1.00  0.00           C  
HETATM   12  C9  UNL     1      -3.536  -4.047   0.931  1.00  0.00           C  
HETATM   13  C10 UNL     1      -3.171  -5.356   1.141  1.00  0.00           C  
HETATM   14  C11 UNL     1      -2.617  -6.121   0.139  1.00  0.00           C  
HETATM   15  C12 UNL     1      -2.450  -5.500  -1.081  1.00  0.00           C  
HETATM   16  C13 UNL     1      -2.813  -4.179  -1.313  1.00  0.00           C  
HETATM   17  N2  UNL     1      -1.542  -1.193  -1.003  1.00  0.00           N  
HETATM   18  C14 UNL     1      -1.558  -1.028  -2.398  1.00  0.00           C  
HETATM   19  O2  UNL     1      -2.662  -0.712  -2.954  1.00  0.00           O  
HETATM   20  C15 UNL     1      -0.423  -1.184  -3.319  1.00  0.00           C  
HETATM   21  N3  UNL     1       0.787  -1.482  -2.594  1.00  0.00           N  
HETATM   22  C16 UNL     1       1.318  -0.536  -1.694  1.00  0.00           C  
HETATM   23  O3  UNL     1       0.752   0.591  -1.518  1.00  0.00           O  
HETATM   24  C17 UNL     1       2.557  -0.855  -0.938  1.00  0.00           C  
HETATM   25  C18 UNL     1       2.326  -2.110  -0.116  1.00  0.00           C  
HETATM   26  N4  UNL     1       2.974   0.252  -0.100  1.00  0.00           N  
HETATM   27  C19 UNL     1       4.294   0.744  -0.074  1.00  0.00           C  
HETATM   28  O4  UNL     1       5.161   0.196  -0.802  1.00  0.00           O  
HETATM   29  C20 UNL     1       4.677   1.864   0.768  1.00  0.00           C  
HETATM   30  N5  UNL     1       3.446   2.420   1.363  1.00  0.00           N  
HETATM   31  C21 UNL     1       5.649   1.507   1.876  1.00  0.00           C  
HETATM   32  C22 UNL     1       6.904   0.927   1.377  1.00  0.00           C  
HETATM   33  C23 UNL     1       8.009   1.651   0.982  1.00  0.00           C  
HETATM   34  C24 UNL     1       9.159   1.027   0.540  1.00  0.00           C  
HETATM   35  C25 UNL     1       9.279  -0.350   0.464  1.00  0.00           C  
HETATM   36  O5  UNL     1      10.429  -0.995   0.022  1.00  0.00           O  
HETATM   37  C26 UNL     1       8.158  -1.077   0.866  1.00  0.00           C  
HETATM   38  C27 UNL     1       7.013  -0.470   1.305  1.00  0.00           C  
HETATM   39  C28 UNL     1      -6.436   1.822  -0.661  1.00  0.00           C  
HETATM   40  N6  UNL     1      -7.255   2.921  -0.976  1.00  0.00           N  
HETATM   41  O6  UNL     1      -6.834   0.684  -1.026  1.00  0.00           O  
HETATM   42  H1  UNL     1      -2.677   4.952   0.978  1.00  0.00           H  
HETATM   43  H2  UNL     1      -3.282   6.657   1.250  1.00  0.00           H  
HETATM   44  H3  UNL     1      -3.676   5.361   2.422  1.00  0.00           H  
HETATM   45  H4  UNL     1      -5.992   4.399   2.437  1.00  0.00           H  
HETATM   46  H5  UNL     1      -7.078   4.007   1.106  1.00  0.00           H  
HETATM   47  H6  UNL     1      -4.358   2.795   1.897  1.00  0.00           H  
HETATM   48  H7  UNL     1      -5.963   2.048   2.105  1.00  0.00           H  
HETATM   49  H8  UNL     1      -4.506   2.669  -0.545  1.00  0.00           H  
HETATM   50  H9  UNL     1      -4.967   0.055   0.895  1.00  0.00           H  
HETATM   51  H10 UNL     1      -2.385  -1.010   0.893  1.00  0.00           H  
HETATM   52  H11 UNL     1      -4.725  -1.796   0.096  1.00  0.00           H  
HETATM   53  H12 UNL     1      -4.091  -1.898  -1.544  1.00  0.00           H  
HETATM   54  H13 UNL     1      -3.966  -3.456   1.711  1.00  0.00           H  
HETATM   55  H14 UNL     1      -3.304  -5.851   2.114  1.00  0.00           H  
HETATM   56  H15 UNL     1      -2.326  -7.149   0.286  1.00  0.00           H  
HETATM   57  H16 UNL     1      -2.013  -6.054  -1.922  1.00  0.00           H  
HETATM   58  H17 UNL     1      -2.670  -3.715  -2.288  1.00  0.00           H  
HETATM   59  H18 UNL     1      -0.633  -1.476  -0.550  1.00  0.00           H  
HETATM   60  H19 UNL     1      -0.581  -1.981  -4.076  1.00  0.00           H  
HETATM   61  H20 UNL     1      -0.285  -0.200  -3.846  1.00  0.00           H  
HETATM   62  H21 UNL     1       1.289  -2.407  -2.727  1.00  0.00           H  
HETATM   63  H22 UNL     1       3.404  -1.094  -1.607  1.00  0.00           H  
HETATM   64  H23 UNL     1       2.045  -2.962  -0.759  1.00  0.00           H  
HETATM   65  H24 UNL     1       3.179  -2.352   0.525  1.00  0.00           H  
HETATM   66  H25 UNL     1       1.465  -1.860   0.566  1.00  0.00           H  
HETATM   67  H26 UNL     1       2.257   0.695   0.504  1.00  0.00           H  
HETATM   68  H27 UNL     1       5.140   2.716   0.212  1.00  0.00           H  
HETATM   69  H28 UNL     1       2.752   2.669   0.656  1.00  0.00           H  
HETATM   70  H29 UNL     1       3.162   1.769   2.107  1.00  0.00           H  
HETATM   71  H30 UNL     1       5.882   2.385   2.512  1.00  0.00           H  
HETATM   72  H31 UNL     1       5.154   0.763   2.532  1.00  0.00           H  
HETATM   73  H32 UNL     1       7.943   2.751   1.029  1.00  0.00           H  
HETATM   74  H33 UNL     1      10.007   1.647   0.239  1.00  0.00           H  
HETATM   75  H34 UNL     1      10.480  -1.187  -0.983  1.00  0.00           H  
HETATM   76  H35 UNL     1       8.252  -2.170   0.807  1.00  0.00           H  
HETATM   77  H36 UNL     1       6.155  -1.088   1.610  1.00  0.00           H  
HETATM   78  H37 UNL     1      -6.866   3.747  -1.445  1.00  0.00           H  
HETATM   79  H38 UNL     1      -8.258   2.879  -0.724  1.00  0.00           H  
CONECT    1    2   42   43   44
CONECT    2    3
CONECT    3    4   45   46
CONECT    4    5   47   48
CONECT    5    6   39   49
CONECT    6    7   50
CONECT    7    8    8    9
CONECT    9   10   17   51
CONECT   10   11   52   53
CONECT   11   12   12   16
CONECT   12   13   54
CONECT   13   14   14   55
CONECT   14   15   56
CONECT   15   16   16   57
CONECT   16   58
CONECT   17   18   59
CONECT   18   19   19   20
CONECT   20   21   60   61
CONECT   21   22   62
CONECT   22   23   23   24
CONECT   24   25   26   63
CONECT   25   64   65   66
CONECT   26   27   67
CONECT   27   28   28   29
CONECT   29   30   31   68
CONECT   30   69   70
CONECT   31   32   71   72
CONECT   32   33   33   38
CONECT   33   34   73
CONECT   34   35   35   74
CONECT   35   36   37
CONECT   36   75
CONECT   37   38   38   76
CONECT   38   77
CONECT   39   40   41   41
CONECT   40   78   79
END
Download

SMILES for HMDB0250832 (Dalamid)

CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)C(N)=O
Download

INCHI for HMDB0250832 (Dalamid)

InChI=1S/C28H38N6O6S/c1-17(32-27(39)21(29)14-19-8-10-20(35)11-9-19)26(38)31-16-24(36)33-23(15-18-6-4-3-5-7-18)28(40)34-22(25(30)37)12-13-41-2/h3-11,17,21-23,35H,12-16,29H2,1-2H3,(H2,30,37)(H,31,38)(H,32,39)(H,33,36)(H,34,40)
Download
View in JSmolView Stereo Labels
Synonyms
ValueSource
2-Ala-met-enkephalinamideMeSH
Ala(2)-met(5)-enkephalinamideMeSH
D-Ala(2)-leu(5)-enkephalinamideMeSH
D-Ala(2)-met(5)-enkephalinamideMeSH
D-Ala(2)-methionine-enkephalinamideMeSH
D-EnkephalinMeSH
DALAMeSH
DAMEMeSH
DalamideMeSH
Enkephalinamide, ala(2), met(5)MeSH
2-{[2-({2-[(2-{[2-amino-1-hydroxy-3-(4-hydroxyphenyl)propylidene]amino}-1-hydroxypropylidene)amino]-1-hydroxyethylidene}amino)-1-hydroxy-3-phenylpropylidene]amino}-4-(methylsulfanyl)butanimidateGenerator
2-{[2-({2-[(2-{[2-amino-1-hydroxy-3-(4-hydroxyphenyl)propylidene]amino}-1-hydroxypropylidene)amino]-1-hydroxyethylidene}amino)-1-hydroxy-3-phenylpropylidene]amino}-4-(methylsulphanyl)butanimidateGenerator
2-{[2-({2-[(2-{[2-amino-1-hydroxy-3-(4-hydroxyphenyl)propylidene]amino}-1-hydroxypropylidene)amino]-1-hydroxyethylidene}amino)-1-hydroxy-3-phenylpropylidene]amino}-4-(methylsulphanyl)butanimidic acidGenerator
Chemical FormulaC28H38N6O6S
Average Molecular Weight586.71
Monoisotopic Molecular Weight586.257354142
IUPAC Name2-[2-(2-{2-[2-amino-3-(4-hydroxyphenyl)propanamido]propanamido}acetamido)-3-phenylpropanamido]-4-(methylsulfanyl)butanamide
Traditional Name2-[2-(2-{2-[2-amino-3-(4-hydroxyphenyl)propanamido]propanamido}acetamido)-3-phenylpropanamido]-4-(methylsulfanyl)butanamide
CAS Registry NumberNot Available
SMILES
CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)C(N)=O
InChI Identifier
InChI=1S/C28H38N6O6S/c1-17(32-27(39)21(29)14-19-8-10-20(35)11-9-19)26(38)31-16-24(36)33-23(15-18-6-4-3-5-7-18)28(40)34-22(25(30)37)12-13-41-2/h3-11,17,21-23,35H,12-16,29H2,1-2H3,(H2,30,37)(H,31,38)(H,32,39)(H,33,36)(H,34,40)
InChI KeyANZXICRKKYOVMY-UHFFFAOYSA-N
Chemical Taxonomy
Description Belongs to the class of organic compounds known as oligopeptides. These are organic compounds containing a sequence of between three and ten alpha-amino acids joined by peptide bonds.
KingdomOrganic compounds
Super ClassOrganic acids and derivatives
ClassCarboxylic acids and derivatives
Sub ClassAmino acids, peptides, and analogues
Direct ParentOligopeptides
Alternative Parents
Substituents
  • Alpha-oligopeptide
  • Tyrosine or derivatives
  • Phenylalanine or derivatives
  • Methionine or derivatives
  • N-acyl-alpha amino acid or derivatives
  • Alpha-amino acid amide
  • Alanine or derivatives
  • Amphetamine or derivatives
  • Alpha-amino acid or derivatives
  • N-substituted-alpha-amino acid
  • 1-hydroxy-2-unsubstituted benzenoid
  • Aralkylamine
  • Phenol
  • Fatty acyl
  • Benzenoid
  • Fatty amide
  • Monocyclic benzene moiety
  • Secondary carboxylic acid amide
  • Primary carboxylic acid amide
  • Carboxamide group
  • Amino acid or derivatives
  • Dialkylthioether
  • Sulfenyl compound
  • Thioether
  • Organic nitrogen compound
  • Organic oxygen compound
  • Organopnictogen compound
  • Organic oxide
  • Hydrocarbon derivative
  • Primary amine
  • Organosulfur compound
  • Organooxygen compound
  • Organonitrogen compound
  • Primary aliphatic amine
  • Carbonyl group
  • Amine
  • Aromatic homomonocyclic compound
Molecular FrameworkAromatic homomonocyclic compounds
External DescriptorsNot Available
Ontology
Physiological effectNot Available
Disposition
Biological location
ProcessNot Available
RoleNot Available
Physical Properties
StateNot Available
Experimental Molecular Properties
PropertyValueReference
Melting PointNot AvailableNot Available
Boiling PointNot AvailableNot Available
Water SolubilityNot AvailableNot Available
LogPNot AvailableNot Available
Experimental Chromatographic PropertiesNot Available
Predicted Molecular Properties
PropertyValueSource
logP0.37ALOGPS
logP-0.58ChemAxon
logS-4.7ALOGPS
pKa (Strongest Acidic)9.51ChemAxon
pKa (Strongest Basic)7.73ChemAxon
Physiological Charge1ChemAxon
Hydrogen Acceptor Count7ChemAxon
Hydrogen Donor Count7ChemAxon
Polar Surface Area205.74 ŲChemAxon
Rotatable Bond Count16ChemAxon
Refractivity155.32 m³·mol⁻¹ChemAxon
Polarizability61.84 ųChemAxon
Number of Rings2ChemAxon
BioavailabilityNoChemAxon
Rule of FiveNoChemAxon
Ghose FilterNoChemAxon
Veber's RuleNoChemAxon
MDDR-like RuleNoChemAxon
Predicted Chromatographic Properties

Predicted Collision Cross Sections

PredictorAdduct TypeCCS Value (Å2)Reference
DeepCCS[M+H]+226.02630932474
DeepCCS[M-H]-223.63130932474
DeepCCS[M-2H]-256.51530932474
DeepCCS[M+Na]+231.93930932474
AllCCS[M+H]+238.732859911
AllCCS[M+H-H2O]+237.632859911
AllCCS[M+NH4]+239.632859911
AllCCS[M+Na]+239.832859911
AllCCS[M-H]-218.432859911
AllCCS[M+Na-2H]-221.032859911
AllCCS[M+HCOO]-224.132859911

Predicted Kovats Retention Indices

Derivatized

Derivative Name / StructureSMILESKovats RI ValueColumn TypeReference
Dalamid,1TMS,isomer #1CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)C(N)=O4983.3Semi standard non polar33892256
Dalamid,1TMS,isomer #1CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)C(N)=O4363.1Standard non polar33892256
Dalamid,1TMS,isomer #1CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)C(N)=O8328.7Standard polar33892256
Dalamid,1TMS,isomer #2CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)C(N)=O5045.6Semi standard non polar33892256
Dalamid,1TMS,isomer #2CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)C(N)=O4425.6Standard non polar33892256
Dalamid,1TMS,isomer #2CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)C(N)=O8165.0Standard polar33892256
Dalamid,1TMS,isomer #3CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)C(=O)N[Si](C)(C)C4973.4Semi standard non polar33892256
Dalamid,1TMS,isomer #3CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)C(=O)N[Si](C)(C)C4394.8Standard non polar33892256
Dalamid,1TMS,isomer #3CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)C(=O)N[Si](C)(C)C8118.3Standard polar33892256
Dalamid,1TMS,isomer #4CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C4867.7Semi standard non polar33892256
Dalamid,1TMS,isomer #4CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C4345.0Standard non polar33892256
Dalamid,1TMS,isomer #4CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C8566.6Standard polar33892256
Dalamid,1TMS,isomer #5CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)C(N)=O4891.2Semi standard non polar33892256
Dalamid,1TMS,isomer #5CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)C(N)=O4410.9Standard non polar33892256
Dalamid,1TMS,isomer #5CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)C(N)=O8677.0Standard polar33892256
Dalamid,1TMS,isomer #6CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)C(N)=O4919.1Semi standard non polar33892256
Dalamid,1TMS,isomer #6CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)C(N)=O4421.4Standard non polar33892256
Dalamid,1TMS,isomer #6CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)C(N)=O8629.6Standard polar33892256
Dalamid,1TMS,isomer #7CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)C(N)=O4865.7Semi standard non polar33892256
Dalamid,1TMS,isomer #7CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)C(N)=O4412.5Standard non polar33892256
Dalamid,1TMS,isomer #7CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)C(N)=O8497.7Standard polar33892256
Dalamid,2TMS,isomer #1CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O[Si](C)(C)C)C=C1)N[Si](C)(C)C)C(N)=O4960.3Semi standard non polar33892256
Dalamid,2TMS,isomer #1CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O[Si](C)(C)C)C=C1)N[Si](C)(C)C)C(N)=O4373.4Standard non polar33892256
Dalamid,2TMS,isomer #1CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O[Si](C)(C)C)C=C1)N[Si](C)(C)C)C(N)=O7495.8Standard polar33892256
Dalamid,2TMS,isomer #10CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C)C(N)=O4899.5Semi standard non polar33892256
Dalamid,2TMS,isomer #10CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C)C(N)=O4420.0Standard non polar33892256
Dalamid,2TMS,isomer #10CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C)C(N)=O7729.2Standard polar33892256
Dalamid,2TMS,isomer #11CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C)C(N)=O4877.0Semi standard non polar33892256
Dalamid,2TMS,isomer #11CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C)C(N)=O4418.9Standard non polar33892256
Dalamid,2TMS,isomer #11CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C)C(N)=O7712.6Standard polar33892256
Dalamid,2TMS,isomer #12CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N([Si](C)(C)C)[Si](C)(C)C)C(N)=O4994.6Semi standard non polar33892256
Dalamid,2TMS,isomer #12CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N([Si](C)(C)C)[Si](C)(C)C)C(N)=O4497.6Standard non polar33892256
Dalamid,2TMS,isomer #12CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N([Si](C)(C)C)[Si](C)(C)C)C(N)=O7826.9Standard polar33892256
Dalamid,2TMS,isomer #13CSCCC(C(=O)N[Si](C)(C)C)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C4761.7Semi standard non polar33892256
Dalamid,2TMS,isomer #13CSCCC(C(=O)N[Si](C)(C)C)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C4365.3Standard non polar33892256
Dalamid,2TMS,isomer #13CSCCC(C(=O)N[Si](C)(C)C)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C7661.8Standard polar33892256
Dalamid,2TMS,isomer #14CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)C(=O)N[Si](C)(C)C4828.4Semi standard non polar33892256
Dalamid,2TMS,isomer #14CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)C(=O)N[Si](C)(C)C4408.8Standard non polar33892256
Dalamid,2TMS,isomer #14CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)C(=O)N[Si](C)(C)C7694.2Standard polar33892256
Dalamid,2TMS,isomer #15CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)C(=O)N[Si](C)(C)C4853.7Semi standard non polar33892256
Dalamid,2TMS,isomer #15CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)C(=O)N[Si](C)(C)C4410.9Standard non polar33892256
Dalamid,2TMS,isomer #15CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)C(=O)N[Si](C)(C)C7656.3Standard polar33892256
Dalamid,2TMS,isomer #16CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)C(=O)N[Si](C)(C)C4810.7Semi standard non polar33892256
Dalamid,2TMS,isomer #16CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)C(=O)N[Si](C)(C)C4434.1Standard non polar33892256
Dalamid,2TMS,isomer #16CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)C(=O)N[Si](C)(C)C7488.1Standard polar33892256
Dalamid,2TMS,isomer #17CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)C(=O)N([Si](C)(C)C)[Si](C)(C)C4946.0Semi standard non polar33892256
Dalamid,2TMS,isomer #17CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)C(=O)N([Si](C)(C)C)[Si](C)(C)C4452.9Standard non polar33892256
Dalamid,2TMS,isomer #17CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)C(=O)N([Si](C)(C)C)[Si](C)(C)C7718.7Standard polar33892256
Dalamid,2TMS,isomer #18CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C4710.2Semi standard non polar33892256
Dalamid,2TMS,isomer #18CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C4367.3Standard non polar33892256
Dalamid,2TMS,isomer #18CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C8197.8Standard polar33892256
Dalamid,2TMS,isomer #19CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C4728.2Semi standard non polar33892256
Dalamid,2TMS,isomer #19CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C4372.2Standard non polar33892256
Dalamid,2TMS,isomer #19CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C8141.3Standard polar33892256
Dalamid,2TMS,isomer #2CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)C(=O)N[Si](C)(C)C4919.0Semi standard non polar33892256
Dalamid,2TMS,isomer #2CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)C(=O)N[Si](C)(C)C4348.7Standard non polar33892256
Dalamid,2TMS,isomer #2CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)C(=O)N[Si](C)(C)C7415.6Standard polar33892256
Dalamid,2TMS,isomer #20CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C4716.4Semi standard non polar33892256
Dalamid,2TMS,isomer #20CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C4369.7Standard non polar33892256
Dalamid,2TMS,isomer #20CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C8014.2Standard polar33892256
Dalamid,2TMS,isomer #21CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CN(C(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(N)=O4757.4Semi standard non polar33892256
Dalamid,2TMS,isomer #21CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CN(C(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(N)=O4410.4Standard non polar33892256
Dalamid,2TMS,isomer #21CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CN(C(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(N)=O8265.7Standard polar33892256
Dalamid,2TMS,isomer #22CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)N(C(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(N)=O4739.5Semi standard non polar33892256
Dalamid,2TMS,isomer #22CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)N(C(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(N)=O4427.5Standard non polar33892256
Dalamid,2TMS,isomer #22CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)N(C(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(N)=O8129.4Standard polar33892256
Dalamid,2TMS,isomer #23CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)N(C(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(N)=O4756.4Semi standard non polar33892256
Dalamid,2TMS,isomer #23CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)N(C(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(N)=O4438.9Standard non polar33892256
Dalamid,2TMS,isomer #23CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)N(C(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(N)=O8096.4Standard polar33892256
Dalamid,2TMS,isomer #3CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C4816.4Semi standard non polar33892256
Dalamid,2TMS,isomer #3CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C4293.1Standard non polar33892256
Dalamid,2TMS,isomer #3CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C7886.5Standard polar33892256
Dalamid,2TMS,isomer #4CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)C(N)=O4835.2Semi standard non polar33892256
Dalamid,2TMS,isomer #4CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)C(N)=O4359.8Standard non polar33892256
Dalamid,2TMS,isomer #4CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)C(N)=O8001.9Standard polar33892256
Dalamid,2TMS,isomer #5CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)C(N)=O4869.7Semi standard non polar33892256
Dalamid,2TMS,isomer #5CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)C(N)=O4350.1Standard non polar33892256
Dalamid,2TMS,isomer #5CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)C(N)=O7957.8Standard polar33892256
Dalamid,2TMS,isomer #6CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)C(N)=O4832.2Semi standard non polar33892256
Dalamid,2TMS,isomer #6CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)C(N)=O4355.9Standard non polar33892256
Dalamid,2TMS,isomer #6CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)C(N)=O7832.8Standard polar33892256
Dalamid,2TMS,isomer #7CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)C(=O)N[Si](C)(C)C4971.6Semi standard non polar33892256
Dalamid,2TMS,isomer #7CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)C(=O)N[Si](C)(C)C4396.1Standard non polar33892256
Dalamid,2TMS,isomer #7CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)C(=O)N[Si](C)(C)C7156.4Standard polar33892256
Dalamid,2TMS,isomer #8CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C4852.6Semi standard non polar33892256
Dalamid,2TMS,isomer #8CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C4359.0Standard non polar33892256
Dalamid,2TMS,isomer #8CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C7643.1Standard polar33892256
Dalamid,2TMS,isomer #9CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C)C(N)=O4867.2Semi standard non polar33892256
Dalamid,2TMS,isomer #9CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C)C(N)=O4420.0Standard non polar33892256
Dalamid,2TMS,isomer #9CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C)C(N)=O7785.1Standard polar33892256
Dalamid,3TMS,isomer #1CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O[Si](C)(C)C)C=C1)N[Si](C)(C)C)C(=O)N[Si](C)(C)C4916.4Semi standard non polar33892256
Dalamid,3TMS,isomer #1CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O[Si](C)(C)C)C=C1)N[Si](C)(C)C)C(=O)N[Si](C)(C)C4367.2Standard non polar33892256
Dalamid,3TMS,isomer #1CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O[Si](C)(C)C)C=C1)N[Si](C)(C)C)C(=O)N[Si](C)(C)C6583.9Standard polar33892256
Dalamid,3TMS,isomer #10CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)C(=O)N[Si](C)(C)C4793.1Semi standard non polar33892256
Dalamid,3TMS,isomer #10CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)C(=O)N[Si](C)(C)C4380.6Standard non polar33892256
Dalamid,3TMS,isomer #10CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)C(=O)N[Si](C)(C)C6900.5Standard polar33892256
Dalamid,3TMS,isomer #11CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)C(=O)N([Si](C)(C)C)[Si](C)(C)C4911.7Semi standard non polar33892256
Dalamid,3TMS,isomer #11CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)C(=O)N([Si](C)(C)C)[Si](C)(C)C4408.8Standard non polar33892256
Dalamid,3TMS,isomer #11CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)C(=O)N([Si](C)(C)C)[Si](C)(C)C7087.2Standard polar33892256
Dalamid,3TMS,isomer #12CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)[Si](C)(C)C4722.4Semi standard non polar33892256
Dalamid,3TMS,isomer #12CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)[Si](C)(C)C4316.6Standard non polar33892256
Dalamid,3TMS,isomer #12CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)[Si](C)(C)C7589.9Standard polar33892256
Dalamid,3TMS,isomer #13CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)[Si](C)(C)C4717.2Semi standard non polar33892256
Dalamid,3TMS,isomer #13CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)[Si](C)(C)C4301.5Standard non polar33892256
Dalamid,3TMS,isomer #13CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)[Si](C)(C)C7544.5Standard polar33892256
Dalamid,3TMS,isomer #14CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)[Si](C)(C)C4717.9Semi standard non polar33892256
Dalamid,3TMS,isomer #14CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)[Si](C)(C)C4310.0Standard non polar33892256
Dalamid,3TMS,isomer #14CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)[Si](C)(C)C7434.5Standard polar33892256
Dalamid,3TMS,isomer #15CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CN(C(=O)C(C)NC(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(N)=O4765.3Semi standard non polar33892256
Dalamid,3TMS,isomer #15CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CN(C(=O)C(C)NC(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(N)=O4345.7Standard non polar33892256
Dalamid,3TMS,isomer #15CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CN(C(=O)C(C)NC(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(N)=O7656.6Standard polar33892256
Dalamid,3TMS,isomer #16CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)N(C(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(N)=O4743.1Semi standard non polar33892256
Dalamid,3TMS,isomer #16CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)N(C(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(N)=O4363.7Standard non polar33892256
Dalamid,3TMS,isomer #16CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)N(C(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(N)=O7538.1Standard polar33892256
Dalamid,3TMS,isomer #17CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)N(C(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(N)=O4762.6Semi standard non polar33892256
Dalamid,3TMS,isomer #17CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)N(C(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(N)=O4362.1Standard non polar33892256
Dalamid,3TMS,isomer #17CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)N(C(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(N)=O7511.8Standard polar33892256
Dalamid,3TMS,isomer #18CSCCC(C(=O)N[Si](C)(C)C)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C4785.9Semi standard non polar33892256
Dalamid,3TMS,isomer #18CSCCC(C(=O)N[Si](C)(C)C)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C4393.2Standard non polar33892256
Dalamid,3TMS,isomer #18CSCCC(C(=O)N[Si](C)(C)C)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C6721.8Standard polar33892256
Dalamid,3TMS,isomer #19CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C)C(=O)N[Si](C)(C)C4839.0Semi standard non polar33892256
Dalamid,3TMS,isomer #19CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C)C(=O)N[Si](C)(C)C4426.6Standard non polar33892256
Dalamid,3TMS,isomer #19CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C)C(=O)N[Si](C)(C)C6749.8Standard polar33892256
Dalamid,3TMS,isomer #2CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O[Si](C)(C)C)C=C1)N[Si](C)(C)C)[Si](C)(C)C4809.0Semi standard non polar33892256
Dalamid,3TMS,isomer #2CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O[Si](C)(C)C)C=C1)N[Si](C)(C)C)[Si](C)(C)C4319.3Standard non polar33892256
Dalamid,3TMS,isomer #2CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O[Si](C)(C)C)C=C1)N[Si](C)(C)C)[Si](C)(C)C7054.2Standard polar33892256
Dalamid,3TMS,isomer #20CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C)C(=O)N[Si](C)(C)C4854.5Semi standard non polar33892256
Dalamid,3TMS,isomer #20CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C)C(=O)N[Si](C)(C)C4425.8Standard non polar33892256
Dalamid,3TMS,isomer #20CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C)C(=O)N[Si](C)(C)C6709.6Standard polar33892256
Dalamid,3TMS,isomer #21CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C)C(=O)N[Si](C)(C)C4833.5Semi standard non polar33892256
Dalamid,3TMS,isomer #21CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C)C(=O)N[Si](C)(C)C4432.6Standard non polar33892256
Dalamid,3TMS,isomer #21CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C)C(=O)N[Si](C)(C)C6696.5Standard polar33892256
Dalamid,3TMS,isomer #22CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N([Si](C)(C)C)[Si](C)(C)C)C(=O)N[Si](C)(C)C4941.4Semi standard non polar33892256
Dalamid,3TMS,isomer #22CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N([Si](C)(C)C)[Si](C)(C)C)C(=O)N[Si](C)(C)C4484.2Standard non polar33892256
Dalamid,3TMS,isomer #22CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N([Si](C)(C)C)[Si](C)(C)C)C(=O)N[Si](C)(C)C6800.6Standard polar33892256
Dalamid,3TMS,isomer #23CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)C(=O)N([Si](C)(C)C)[Si](C)(C)C4944.3Semi standard non polar33892256
Dalamid,3TMS,isomer #23CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)C(=O)N([Si](C)(C)C)[Si](C)(C)C4463.6Standard non polar33892256
Dalamid,3TMS,isomer #23CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)C(=O)N([Si](C)(C)C)[Si](C)(C)C6768.5Standard polar33892256
Dalamid,3TMS,isomer #24CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4725.0Semi standard non polar33892256
Dalamid,3TMS,isomer #24CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4391.3Standard non polar33892256
Dalamid,3TMS,isomer #24CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C7296.6Standard polar33892256
Dalamid,3TMS,isomer #25CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4736.7Semi standard non polar33892256
Dalamid,3TMS,isomer #25CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4390.8Standard non polar33892256
Dalamid,3TMS,isomer #25CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C7237.8Standard polar33892256
Dalamid,3TMS,isomer #26CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4725.7Semi standard non polar33892256
Dalamid,3TMS,isomer #26CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4396.2Standard non polar33892256
Dalamid,3TMS,isomer #26CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C7231.6Standard polar33892256
Dalamid,3TMS,isomer #27CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4881.7Semi standard non polar33892256
Dalamid,3TMS,isomer #27CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4459.1Standard non polar33892256
Dalamid,3TMS,isomer #27CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C7334.9Standard polar33892256
Dalamid,3TMS,isomer #28CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CN(C(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(N)=O4770.0Semi standard non polar33892256
Dalamid,3TMS,isomer #28CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CN(C(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(N)=O4426.4Standard non polar33892256
Dalamid,3TMS,isomer #28CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CN(C(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(N)=O7377.9Standard polar33892256
Dalamid,3TMS,isomer #29CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)N(C(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(N)=O4752.7Semi standard non polar33892256
Dalamid,3TMS,isomer #29CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)N(C(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(N)=O4447.1Standard non polar33892256
Dalamid,3TMS,isomer #29CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)N(C(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(N)=O7357.7Standard polar33892256
Dalamid,3TMS,isomer #3CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O[Si](C)(C)C)C=C1)N[Si](C)(C)C)[Si](C)(C)C)C(N)=O4835.8Semi standard non polar33892256
Dalamid,3TMS,isomer #3CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O[Si](C)(C)C)C=C1)N[Si](C)(C)C)[Si](C)(C)C)C(N)=O4374.7Standard non polar33892256
Dalamid,3TMS,isomer #3CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O[Si](C)(C)C)C=C1)N[Si](C)(C)C)[Si](C)(C)C)C(N)=O7179.2Standard polar33892256
Dalamid,3TMS,isomer #30CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(N)=O4917.0Semi standard non polar33892256
Dalamid,3TMS,isomer #30CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(N)=O4510.7Standard non polar33892256
Dalamid,3TMS,isomer #30CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(N)=O7466.2Standard polar33892256
Dalamid,3TMS,isomer #31CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)N(C(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(N)=O4776.9Semi standard non polar33892256
Dalamid,3TMS,isomer #31CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)N(C(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(N)=O4446.5Standard non polar33892256
Dalamid,3TMS,isomer #31CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)N(C(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(N)=O7315.9Standard polar33892256
Dalamid,3TMS,isomer #32CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(N)=O4933.2Semi standard non polar33892256
Dalamid,3TMS,isomer #32CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(N)=O4510.5Standard non polar33892256
Dalamid,3TMS,isomer #32CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(N)=O7410.0Standard polar33892256
Dalamid,3TMS,isomer #33CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(CC1=CC=C(O)C=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(N)=O4921.4Semi standard non polar33892256
Dalamid,3TMS,isomer #33CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(CC1=CC=C(O)C=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(N)=O4502.0Standard non polar33892256
Dalamid,3TMS,isomer #33CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(CC1=CC=C(O)C=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(N)=O7404.6Standard polar33892256
Dalamid,3TMS,isomer #34CSCCC(C(=O)N([Si](C)(C)C)[Si](C)(C)C)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C4793.2Semi standard non polar33892256
Dalamid,3TMS,isomer #34CSCCC(C(=O)N([Si](C)(C)C)[Si](C)(C)C)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C4443.9Standard non polar33892256
Dalamid,3TMS,isomer #34CSCCC(C(=O)N([Si](C)(C)C)[Si](C)(C)C)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C7299.0Standard polar33892256
Dalamid,3TMS,isomer #35CSCCC(C(=O)N[Si](C)(C)C)N(C(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C4669.7Semi standard non polar33892256
Dalamid,3TMS,isomer #35CSCCC(C(=O)N[Si](C)(C)C)N(C(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C4408.6Standard non polar33892256
Dalamid,3TMS,isomer #35CSCCC(C(=O)N[Si](C)(C)C)N(C(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C7279.0Standard polar33892256
Dalamid,3TMS,isomer #36CSCCC(C(=O)N[Si](C)(C)C)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C4671.8Semi standard non polar33892256
Dalamid,3TMS,isomer #36CSCCC(C(=O)N[Si](C)(C)C)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C4414.7Standard non polar33892256
Dalamid,3TMS,isomer #36CSCCC(C(=O)N[Si](C)(C)C)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C7238.5Standard polar33892256
Dalamid,3TMS,isomer #37CSCCC(C(=O)N[Si](C)(C)C)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C4675.4Semi standard non polar33892256
Dalamid,3TMS,isomer #37CSCCC(C(=O)N[Si](C)(C)C)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C4427.5Standard non polar33892256
Dalamid,3TMS,isomer #37CSCCC(C(=O)N[Si](C)(C)C)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C7097.0Standard polar33892256
Dalamid,3TMS,isomer #38CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CN(C(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(=O)N[Si](C)(C)C4727.6Semi standard non polar33892256
Dalamid,3TMS,isomer #38CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CN(C(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(=O)N[Si](C)(C)C4434.5Standard non polar33892256
Dalamid,3TMS,isomer #38CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CN(C(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(=O)N[Si](C)(C)C7280.0Standard polar33892256
Dalamid,3TMS,isomer #39CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)N(C(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(=O)N[Si](C)(C)C4718.1Semi standard non polar33892256
Dalamid,3TMS,isomer #39CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)N(C(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(=O)N[Si](C)(C)C4464.2Standard non polar33892256
Dalamid,3TMS,isomer #39CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)N(C(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(=O)N[Si](C)(C)C7123.1Standard polar33892256
Dalamid,3TMS,isomer #4CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(CC1=CC=C(O[Si](C)(C)C)C=C1)N[Si](C)(C)C)[Si](C)(C)C)C(N)=O4850.5Semi standard non polar33892256
Dalamid,3TMS,isomer #4CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(CC1=CC=C(O[Si](C)(C)C)C=C1)N[Si](C)(C)C)[Si](C)(C)C)C(N)=O4360.9Standard non polar33892256
Dalamid,3TMS,isomer #4CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(CC1=CC=C(O[Si](C)(C)C)C=C1)N[Si](C)(C)C)[Si](C)(C)C)C(N)=O7133.3Standard polar33892256
Dalamid,3TMS,isomer #40CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)C(=O)N([Si](C)(C)C)[Si](C)(C)C4831.5Semi standard non polar33892256
Dalamid,3TMS,isomer #40CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)C(=O)N([Si](C)(C)C)[Si](C)(C)C4490.0Standard non polar33892256
Dalamid,3TMS,isomer #40CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)C(=O)N([Si](C)(C)C)[Si](C)(C)C7324.4Standard polar33892256
Dalamid,3TMS,isomer #41CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)N(C(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(=O)N[Si](C)(C)C4716.6Semi standard non polar33892256
Dalamid,3TMS,isomer #41CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)N(C(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(=O)N[Si](C)(C)C4463.2Standard non polar33892256
Dalamid,3TMS,isomer #41CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)N(C(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(=O)N[Si](C)(C)C7102.9Standard polar33892256
Dalamid,3TMS,isomer #42CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)C(=O)N([Si](C)(C)C)[Si](C)(C)C4864.2Semi standard non polar33892256
Dalamid,3TMS,isomer #42CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)C(=O)N([Si](C)(C)C)[Si](C)(C)C4481.8Standard non polar33892256
Dalamid,3TMS,isomer #42CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)C(=O)N([Si](C)(C)C)[Si](C)(C)C7297.5Standard polar33892256
Dalamid,3TMS,isomer #43CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)C(=O)N([Si](C)(C)C)[Si](C)(C)C4848.2Semi standard non polar33892256
Dalamid,3TMS,isomer #43CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)C(=O)N([Si](C)(C)C)[Si](C)(C)C4508.8Standard non polar33892256
Dalamid,3TMS,isomer #43CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)C(=O)N([Si](C)(C)C)[Si](C)(C)C7149.2Standard polar33892256
Dalamid,3TMS,isomer #44CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)N(C(=O)CN(C(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4638.4Semi standard non polar33892256
Dalamid,3TMS,isomer #44CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)N(C(=O)CN(C(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4376.3Standard non polar33892256
Dalamid,3TMS,isomer #44CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)N(C(=O)CN(C(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C7801.3Standard polar33892256
Dalamid,3TMS,isomer #45CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)N(C(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4640.1Semi standard non polar33892256
Dalamid,3TMS,isomer #45CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)N(C(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4392.0Standard non polar33892256
Dalamid,3TMS,isomer #45CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)N(C(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C7682.5Standard polar33892256
Dalamid,3TMS,isomer #46CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)N(C(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4628.3Semi standard non polar33892256
Dalamid,3TMS,isomer #46CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)N(C(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4395.4Standard non polar33892256
Dalamid,3TMS,isomer #46CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)N(C(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C7648.0Standard polar33892256
Dalamid,3TMS,isomer #47CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CN(C(=O)C(C)N(C(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(N)=O4674.0Semi standard non polar33892256
Dalamid,3TMS,isomer #47CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CN(C(=O)C(C)N(C(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(N)=O4434.8Standard non polar33892256
Dalamid,3TMS,isomer #47CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CN(C(=O)C(C)N(C(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(N)=O7757.9Standard polar33892256
Dalamid,3TMS,isomer #5CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(CC1=CC=C(O[Si](C)(C)C)C=C1)N[Si](C)(C)C)[Si](C)(C)C)C(N)=O4847.0Semi standard non polar33892256
Dalamid,3TMS,isomer #5CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(CC1=CC=C(O[Si](C)(C)C)C=C1)N[Si](C)(C)C)[Si](C)(C)C)C(N)=O4371.8Standard non polar33892256
Dalamid,3TMS,isomer #5CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(CC1=CC=C(O[Si](C)(C)C)C=C1)N[Si](C)(C)C)[Si](C)(C)C)C(N)=O7118.9Standard polar33892256
Dalamid,3TMS,isomer #6CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O[Si](C)(C)C)C=C1)N([Si](C)(C)C)[Si](C)(C)C)C(N)=O4944.5Semi standard non polar33892256
Dalamid,3TMS,isomer #6CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O[Si](C)(C)C)C=C1)N([Si](C)(C)C)[Si](C)(C)C)C(N)=O4446.5Standard non polar33892256
Dalamid,3TMS,isomer #6CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O[Si](C)(C)C)C=C1)N([Si](C)(C)C)[Si](C)(C)C)C(N)=O7215.1Standard polar33892256
Dalamid,3TMS,isomer #7CSCCC(C(=O)N[Si](C)(C)C)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C4749.6Semi standard non polar33892256
Dalamid,3TMS,isomer #7CSCCC(C(=O)N[Si](C)(C)C)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C4331.6Standard non polar33892256
Dalamid,3TMS,isomer #7CSCCC(C(=O)N[Si](C)(C)C)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C7046.2Standard polar33892256
Dalamid,3TMS,isomer #8CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)C(=O)N[Si](C)(C)C4807.0Semi standard non polar33892256
Dalamid,3TMS,isomer #8CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)C(=O)N[Si](C)(C)C4368.4Standard non polar33892256
Dalamid,3TMS,isomer #8CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)C(=O)N[Si](C)(C)C7074.8Standard polar33892256
Dalamid,3TMS,isomer #9CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)C(=O)N[Si](C)(C)C4817.2Semi standard non polar33892256
Dalamid,3TMS,isomer #9CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)C(=O)N[Si](C)(C)C4358.2Standard non polar33892256
Dalamid,3TMS,isomer #9CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)C(=O)N[Si](C)(C)C7045.2Standard polar33892256
Dalamid,4TMS,isomer #1CSCCC(C(=O)N[Si](C)(C)C)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O[Si](C)(C)C)C=C1)N[Si](C)(C)C)[Si](C)(C)C4749.1Semi standard non polar33892256
Dalamid,4TMS,isomer #1CSCCC(C(=O)N[Si](C)(C)C)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O[Si](C)(C)C)C=C1)N[Si](C)(C)C)[Si](C)(C)C4356.3Standard non polar33892256
Dalamid,4TMS,isomer #1CSCCC(C(=O)N[Si](C)(C)C)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O[Si](C)(C)C)C=C1)N[Si](C)(C)C)[Si](C)(C)C6255.6Standard polar33892256
Dalamid,4TMS,isomer #10CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O[Si](C)(C)C)C=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4872.1Semi standard non polar33892256
Dalamid,4TMS,isomer #10CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O[Si](C)(C)C)C=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4402.2Standard non polar33892256
Dalamid,4TMS,isomer #10CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O[Si](C)(C)C)C=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C6820.3Standard polar33892256
Dalamid,4TMS,isomer #11CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CN(C(=O)C(C)NC(=O)C(CC1=CC=C(O[Si](C)(C)C)C=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(N)=O4756.0Semi standard non polar33892256
Dalamid,4TMS,isomer #11CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CN(C(=O)C(C)NC(=O)C(CC1=CC=C(O[Si](C)(C)C)C=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(N)=O4359.7Standard non polar33892256
Dalamid,4TMS,isomer #11CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CN(C(=O)C(C)NC(=O)C(CC1=CC=C(O[Si](C)(C)C)C=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(N)=O6862.9Standard polar33892256
Dalamid,4TMS,isomer #12CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)N(C(=O)C(CC1=CC=C(O[Si](C)(C)C)C=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(N)=O4744.9Semi standard non polar33892256
Dalamid,4TMS,isomer #12CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)N(C(=O)C(CC1=CC=C(O[Si](C)(C)C)C=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(N)=O4383.7Standard non polar33892256
Dalamid,4TMS,isomer #12CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)N(C(=O)C(CC1=CC=C(O[Si](C)(C)C)C=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(N)=O6848.1Standard polar33892256
Dalamid,4TMS,isomer #13CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O[Si](C)(C)C)C=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(N)=O4901.0Semi standard non polar33892256
Dalamid,4TMS,isomer #13CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O[Si](C)(C)C)C=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(N)=O4448.7Standard non polar33892256
Dalamid,4TMS,isomer #13CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O[Si](C)(C)C)C=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(N)=O6930.3Standard polar33892256
Dalamid,4TMS,isomer #14CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)N(C(=O)C(CC1=CC=C(O[Si](C)(C)C)C=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(N)=O4768.3Semi standard non polar33892256
Dalamid,4TMS,isomer #14CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)N(C(=O)C(CC1=CC=C(O[Si](C)(C)C)C=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(N)=O4374.5Standard non polar33892256
Dalamid,4TMS,isomer #14CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)N(C(=O)C(CC1=CC=C(O[Si](C)(C)C)C=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(N)=O6814.1Standard polar33892256
Dalamid,4TMS,isomer #15CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(CC1=CC=C(O[Si](C)(C)C)C=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(N)=O4916.2Semi standard non polar33892256
Dalamid,4TMS,isomer #15CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(CC1=CC=C(O[Si](C)(C)C)C=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(N)=O4439.0Standard non polar33892256
Dalamid,4TMS,isomer #15CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(CC1=CC=C(O[Si](C)(C)C)C=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(N)=O6884.4Standard polar33892256
Dalamid,4TMS,isomer #16CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(CC1=CC=C(O[Si](C)(C)C)C=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(N)=O4924.2Semi standard non polar33892256
Dalamid,4TMS,isomer #16CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(CC1=CC=C(O[Si](C)(C)C)C=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(N)=O4444.6Standard non polar33892256
Dalamid,4TMS,isomer #16CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(CC1=CC=C(O[Si](C)(C)C)C=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(N)=O6881.3Standard polar33892256
Dalamid,4TMS,isomer #17CSCCC(C(=O)N([Si](C)(C)C)[Si](C)(C)C)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C4813.7Semi standard non polar33892256
Dalamid,4TMS,isomer #17CSCCC(C(=O)N([Si](C)(C)C)[Si](C)(C)C)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C4401.7Standard non polar33892256
Dalamid,4TMS,isomer #17CSCCC(C(=O)N([Si](C)(C)C)[Si](C)(C)C)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C6768.6Standard polar33892256
Dalamid,4TMS,isomer #18CSCCC(C(=O)N[Si](C)(C)C)N(C(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)[Si](C)(C)C4674.1Semi standard non polar33892256
Dalamid,4TMS,isomer #18CSCCC(C(=O)N[Si](C)(C)C)N(C(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)[Si](C)(C)C4362.8Standard non polar33892256
Dalamid,4TMS,isomer #18CSCCC(C(=O)N[Si](C)(C)C)N(C(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)[Si](C)(C)C6760.5Standard polar33892256
Dalamid,4TMS,isomer #19CSCCC(C(=O)N[Si](C)(C)C)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)[Si](C)(C)C4671.4Semi standard non polar33892256
Dalamid,4TMS,isomer #19CSCCC(C(=O)N[Si](C)(C)C)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)[Si](C)(C)C4353.4Standard non polar33892256
Dalamid,4TMS,isomer #19CSCCC(C(=O)N[Si](C)(C)C)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)[Si](C)(C)C6730.0Standard polar33892256
Dalamid,4TMS,isomer #2CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O[Si](C)(C)C)C=C1)N[Si](C)(C)C)[Si](C)(C)C)C(=O)N[Si](C)(C)C4799.7Semi standard non polar33892256
Dalamid,4TMS,isomer #2CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O[Si](C)(C)C)C=C1)N[Si](C)(C)C)[Si](C)(C)C)C(=O)N[Si](C)(C)C4384.2Standard non polar33892256
Dalamid,4TMS,isomer #2CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O[Si](C)(C)C)C=C1)N[Si](C)(C)C)[Si](C)(C)C)C(=O)N[Si](C)(C)C6280.1Standard polar33892256
Dalamid,4TMS,isomer #20CSCCC(C(=O)N[Si](C)(C)C)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)[Si](C)(C)C4674.9Semi standard non polar33892256
Dalamid,4TMS,isomer #20CSCCC(C(=O)N[Si](C)(C)C)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)[Si](C)(C)C4362.1Standard non polar33892256
Dalamid,4TMS,isomer #20CSCCC(C(=O)N[Si](C)(C)C)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)[Si](C)(C)C6614.5Standard polar33892256
Dalamid,4TMS,isomer #21CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CN(C(=O)C(C)NC(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(=O)N[Si](C)(C)C4721.6Semi standard non polar33892256
Dalamid,4TMS,isomer #21CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CN(C(=O)C(C)NC(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(=O)N[Si](C)(C)C4372.1Standard non polar33892256
Dalamid,4TMS,isomer #21CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CN(C(=O)C(C)NC(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(=O)N[Si](C)(C)C6765.4Standard polar33892256
Dalamid,4TMS,isomer #22CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)N(C(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(=O)N[Si](C)(C)C4705.9Semi standard non polar33892256
Dalamid,4TMS,isomer #22CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)N(C(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(=O)N[Si](C)(C)C4391.1Standard non polar33892256
Dalamid,4TMS,isomer #22CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)N(C(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(=O)N[Si](C)(C)C6635.9Standard polar33892256
Dalamid,4TMS,isomer #23CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)C(=O)N([Si](C)(C)C)[Si](C)(C)C4828.1Semi standard non polar33892256
Dalamid,4TMS,isomer #23CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)C(=O)N([Si](C)(C)C)[Si](C)(C)C4440.8Standard non polar33892256
Dalamid,4TMS,isomer #23CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)C(=O)N([Si](C)(C)C)[Si](C)(C)C6789.0Standard polar33892256
Dalamid,4TMS,isomer #24CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)N(C(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(=O)N[Si](C)(C)C4729.4Semi standard non polar33892256
Dalamid,4TMS,isomer #24CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)N(C(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(=O)N[Si](C)(C)C4378.9Standard non polar33892256
Dalamid,4TMS,isomer #24CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)N(C(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(=O)N[Si](C)(C)C6621.7Standard polar33892256
Dalamid,4TMS,isomer #25CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)C(=O)N([Si](C)(C)C)[Si](C)(C)C4854.1Semi standard non polar33892256
Dalamid,4TMS,isomer #25CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)C(=O)N([Si](C)(C)C)[Si](C)(C)C4417.7Standard non polar33892256
Dalamid,4TMS,isomer #25CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)C(=O)N([Si](C)(C)C)[Si](C)(C)C6769.7Standard polar33892256
Dalamid,4TMS,isomer #26CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)C(=O)N([Si](C)(C)C)[Si](C)(C)C4844.7Semi standard non polar33892256
Dalamid,4TMS,isomer #26CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)C(=O)N([Si](C)(C)C)[Si](C)(C)C4434.8Standard non polar33892256
Dalamid,4TMS,isomer #26CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)C(=O)N([Si](C)(C)C)[Si](C)(C)C6646.7Standard polar33892256
Dalamid,4TMS,isomer #27CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)N(C(=O)CN(C(=O)C(C)NC(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4680.6Semi standard non polar33892256
Dalamid,4TMS,isomer #27CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)N(C(=O)CN(C(=O)C(C)NC(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4320.2Standard non polar33892256
Dalamid,4TMS,isomer #27CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)N(C(=O)CN(C(=O)C(C)NC(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C7280.9Standard polar33892256
Dalamid,4TMS,isomer #28CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)N(C(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4669.5Semi standard non polar33892256
Dalamid,4TMS,isomer #28CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)N(C(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4336.3Standard non polar33892256
Dalamid,4TMS,isomer #28CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)N(C(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C7182.8Standard polar33892256
Dalamid,4TMS,isomer #29CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)N(C(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4669.7Semi standard non polar33892256
Dalamid,4TMS,isomer #29CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)N(C(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4325.7Standard non polar33892256
Dalamid,4TMS,isomer #29CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)N(C(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C7152.6Standard polar33892256
Dalamid,4TMS,isomer #3CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(CC1=CC=C(O[Si](C)(C)C)C=C1)N[Si](C)(C)C)[Si](C)(C)C)C(=O)N[Si](C)(C)C4806.7Semi standard non polar33892256
Dalamid,4TMS,isomer #3CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(CC1=CC=C(O[Si](C)(C)C)C=C1)N[Si](C)(C)C)[Si](C)(C)C)C(=O)N[Si](C)(C)C4371.5Standard non polar33892256
Dalamid,4TMS,isomer #3CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(CC1=CC=C(O[Si](C)(C)C)C=C1)N[Si](C)(C)C)[Si](C)(C)C)C(=O)N[Si](C)(C)C6242.2Standard polar33892256
Dalamid,4TMS,isomer #30CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CN(C(=O)C(C)N(C(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(N)=O4719.3Semi standard non polar33892256
Dalamid,4TMS,isomer #30CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CN(C(=O)C(C)N(C(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(N)=O4361.7Standard non polar33892256
Dalamid,4TMS,isomer #30CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CN(C(=O)C(C)N(C(=O)C(N)CC1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(N)=O7248.9Standard polar33892256
Dalamid,4TMS,isomer #31CSCCC(C(=O)N([Si](C)(C)C)[Si](C)(C)C)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C4812.7Semi standard non polar33892256
Dalamid,4TMS,isomer #31CSCCC(C(=O)N([Si](C)(C)C)[Si](C)(C)C)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C4457.7Standard non polar33892256
Dalamid,4TMS,isomer #31CSCCC(C(=O)N([Si](C)(C)C)[Si](C)(C)C)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C6403.1Standard polar33892256
Dalamid,4TMS,isomer #32CSCCC(C(=O)N[Si](C)(C)C)N(C(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4701.3Semi standard non polar33892256
Dalamid,4TMS,isomer #32CSCCC(C(=O)N[Si](C)(C)C)N(C(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4432.9Standard non polar33892256
Dalamid,4TMS,isomer #32CSCCC(C(=O)N[Si](C)(C)C)N(C(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C6398.0Standard polar33892256
Dalamid,4TMS,isomer #33CSCCC(C(=O)N[Si](C)(C)C)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4710.4Semi standard non polar33892256
Dalamid,4TMS,isomer #33CSCCC(C(=O)N[Si](C)(C)C)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4436.4Standard non polar33892256
Dalamid,4TMS,isomer #33CSCCC(C(=O)N[Si](C)(C)C)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C6353.3Standard polar33892256
Dalamid,4TMS,isomer #34CSCCC(C(=O)N[Si](C)(C)C)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4690.8Semi standard non polar33892256
Dalamid,4TMS,isomer #34CSCCC(C(=O)N[Si](C)(C)C)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4443.4Standard non polar33892256
Dalamid,4TMS,isomer #34CSCCC(C(=O)N[Si](C)(C)C)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C6352.1Standard polar33892256
Dalamid,4TMS,isomer #35CSCCC(C(=O)N[Si](C)(C)C)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4843.4Semi standard non polar33892256
Dalamid,4TMS,isomer #35CSCCC(C(=O)N[Si](C)(C)C)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4491.9Standard non polar33892256
Dalamid,4TMS,isomer #35CSCCC(C(=O)N[Si](C)(C)C)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C6435.6Standard polar33892256
Dalamid,4TMS,isomer #36CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CN(C(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(=O)N[Si](C)(C)C4768.4Semi standard non polar33892256
Dalamid,4TMS,isomer #36CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CN(C(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(=O)N[Si](C)(C)C4455.7Standard non polar33892256
Dalamid,4TMS,isomer #36CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CN(C(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(=O)N[Si](C)(C)C6384.1Standard polar33892256
Dalamid,4TMS,isomer #37CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)N(C(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(=O)N[Si](C)(C)C4736.4Semi standard non polar33892256
Dalamid,4TMS,isomer #37CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)N(C(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(=O)N[Si](C)(C)C4477.3Standard non polar33892256
Dalamid,4TMS,isomer #37CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)N(C(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(=O)N[Si](C)(C)C6377.5Standard polar33892256
Dalamid,4TMS,isomer #38CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(=O)N[Si](C)(C)C4886.7Semi standard non polar33892256
Dalamid,4TMS,isomer #38CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(=O)N[Si](C)(C)C4519.2Standard non polar33892256
Dalamid,4TMS,isomer #38CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(=O)N[Si](C)(C)C6461.2Standard polar33892256
Dalamid,4TMS,isomer #39CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C)C(=O)N([Si](C)(C)C)[Si](C)(C)C4852.7Semi standard non polar33892256
Dalamid,4TMS,isomer #39CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C)C(=O)N([Si](C)(C)C)[Si](C)(C)C4500.4Standard non polar33892256
Dalamid,4TMS,isomer #39CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C)C(=O)N([Si](C)(C)C)[Si](C)(C)C6424.3Standard polar33892256
Dalamid,4TMS,isomer #4CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(CC1=CC=C(O[Si](C)(C)C)C=C1)N[Si](C)(C)C)[Si](C)(C)C)C(=O)N[Si](C)(C)C4797.8Semi standard non polar33892256
Dalamid,4TMS,isomer #4CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(CC1=CC=C(O[Si](C)(C)C)C=C1)N[Si](C)(C)C)[Si](C)(C)C)C(=O)N[Si](C)(C)C4388.0Standard non polar33892256
Dalamid,4TMS,isomer #4CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(CC1=CC=C(O[Si](C)(C)C)C=C1)N[Si](C)(C)C)[Si](C)(C)C)C(=O)N[Si](C)(C)C6237.8Standard polar33892256
Dalamid,4TMS,isomer #40CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)N(C(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(=O)N[Si](C)(C)C4767.5Semi standard non polar33892256
Dalamid,4TMS,isomer #40CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)N(C(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(=O)N[Si](C)(C)C4468.8Standard non polar33892256
Dalamid,4TMS,isomer #40CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)N(C(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(=O)N[Si](C)(C)C6344.1Standard polar33892256
Dalamid,4TMS,isomer #41CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(=O)N[Si](C)(C)C4909.2Semi standard non polar33892256
Dalamid,4TMS,isomer #41CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(=O)N[Si](C)(C)C4521.6Standard non polar33892256
Dalamid,4TMS,isomer #41CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(=O)N[Si](C)(C)C6423.0Standard polar33892256
Dalamid,4TMS,isomer #42CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C)C(=O)N([Si](C)(C)C)[Si](C)(C)C4880.7Semi standard non polar33892256
Dalamid,4TMS,isomer #42CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C)C(=O)N([Si](C)(C)C)[Si](C)(C)C4485.9Standard non polar33892256
Dalamid,4TMS,isomer #42CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C)C(=O)N([Si](C)(C)C)[Si](C)(C)C6387.5Standard polar33892256
Dalamid,4TMS,isomer #43CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(CC1=CC=C(O)C=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(=O)N[Si](C)(C)C4889.9Semi standard non polar33892256
Dalamid,4TMS,isomer #43CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(CC1=CC=C(O)C=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(=O)N[Si](C)(C)C4508.9Standard non polar33892256
Dalamid,4TMS,isomer #43CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(CC1=CC=C(O)C=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(=O)N[Si](C)(C)C6423.8Standard polar33892256
Dalamid,4TMS,isomer #44CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C)C(=O)N([Si](C)(C)C)[Si](C)(C)C4863.3Semi standard non polar33892256
Dalamid,4TMS,isomer #44CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C)C(=O)N([Si](C)(C)C)[Si](C)(C)C4500.8Standard non polar33892256
Dalamid,4TMS,isomer #44CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C)C(=O)N([Si](C)(C)C)[Si](C)(C)C6382.2Standard polar33892256
Dalamid,4TMS,isomer #45CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N([Si](C)(C)C)[Si](C)(C)C)C(=O)N([Si](C)(C)C)[Si](C)(C)C4977.8Semi standard non polar33892256
Dalamid,4TMS,isomer #45CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N([Si](C)(C)C)[Si](C)(C)C)C(=O)N([Si](C)(C)C)[Si](C)(C)C4553.0Standard non polar33892256
Dalamid,4TMS,isomer #45CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N([Si](C)(C)C)[Si](C)(C)C)C(=O)N([Si](C)(C)C)[Si](C)(C)C6465.1Standard polar33892256
Dalamid,4TMS,isomer #46CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)N(C(=O)CN(C(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4674.0Semi standard non polar33892256
Dalamid,4TMS,isomer #46CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)N(C(=O)CN(C(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4403.0Standard non polar33892256
Dalamid,4TMS,isomer #46CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)N(C(=O)CN(C(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C6946.9Standard polar33892256
Dalamid,4TMS,isomer #47CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)N(C(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4661.9Semi standard non polar33892256
Dalamid,4TMS,isomer #47CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)N(C(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4426.7Standard non polar33892256
Dalamid,4TMS,isomer #47CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)N(C(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C6939.9Standard polar33892256
Dalamid,4TMS,isomer #48CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4835.0Semi standard non polar33892256
Dalamid,4TMS,isomer #48CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4478.7Standard non polar33892256
Dalamid,4TMS,isomer #48CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C7027.6Standard polar33892256
Dalamid,4TMS,isomer #49CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)N(C(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4672.4Semi standard non polar33892256
Dalamid,4TMS,isomer #49CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)N(C(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4429.3Standard non polar33892256
Dalamid,4TMS,isomer #49CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)N(C(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C6895.4Standard polar33892256
Dalamid,4TMS,isomer #5CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O[Si](C)(C)C)C=C1)N([Si](C)(C)C)[Si](C)(C)C)C(=O)N[Si](C)(C)C4894.7Semi standard non polar33892256
Dalamid,4TMS,isomer #5CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O[Si](C)(C)C)C=C1)N([Si](C)(C)C)[Si](C)(C)C)C(=O)N[Si](C)(C)C4445.0Standard non polar33892256
Dalamid,4TMS,isomer #5CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O[Si](C)(C)C)C=C1)N([Si](C)(C)C)[Si](C)(C)C)C(=O)N[Si](C)(C)C6318.4Standard polar33892256
Dalamid,4TMS,isomer #50CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4836.4Semi standard non polar33892256
Dalamid,4TMS,isomer #50CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4488.4Standard non polar33892256
Dalamid,4TMS,isomer #50CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C6971.2Standard polar33892256
Dalamid,4TMS,isomer #51CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(CC1=CC=C(O)C=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4849.1Semi standard non polar33892256
Dalamid,4TMS,isomer #51CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(CC1=CC=C(O)C=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4480.6Standard non polar33892256
Dalamid,4TMS,isomer #51CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(CC1=CC=C(O)C=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C6975.3Standard polar33892256
Dalamid,4TMS,isomer #52CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CN(C(=O)C(C)N(C(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(N)=O4706.7Semi standard non polar33892256
Dalamid,4TMS,isomer #52CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CN(C(=O)C(C)N(C(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(N)=O4460.2Standard non polar33892256
Dalamid,4TMS,isomer #52CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CN(C(=O)C(C)N(C(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(N)=O7010.6Standard polar33892256
Dalamid,4TMS,isomer #53CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CN(C(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(N)=O4874.5Semi standard non polar33892256
Dalamid,4TMS,isomer #53CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CN(C(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(N)=O4519.7Standard non polar33892256
Dalamid,4TMS,isomer #53CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CN(C(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(N)=O7091.7Standard polar33892256
Dalamid,4TMS,isomer #54CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)N(C(=O)C(CC1=CC=C(O)C=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(N)=O4877.0Semi standard non polar33892256
Dalamid,4TMS,isomer #54CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)N(C(=O)C(CC1=CC=C(O)C=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(N)=O4527.2Standard non polar33892256
Dalamid,4TMS,isomer #54CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)N(C(=O)C(CC1=CC=C(O)C=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(N)=O7082.8Standard polar33892256
Dalamid,4TMS,isomer #55CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)N(C(=O)C(CC1=CC=C(O)C=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(N)=O4885.0Semi standard non polar33892256
Dalamid,4TMS,isomer #55CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)N(C(=O)C(CC1=CC=C(O)C=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(N)=O4529.9Standard non polar33892256
Dalamid,4TMS,isomer #55CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)N(C(=O)C(CC1=CC=C(O)C=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(N)=O7040.1Standard polar33892256
Dalamid,4TMS,isomer #56CSCCC(C(=O)N([Si](C)(C)C)[Si](C)(C)C)N(C(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C4756.4Semi standard non polar33892256
Dalamid,4TMS,isomer #56CSCCC(C(=O)N([Si](C)(C)C)[Si](C)(C)C)N(C(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C4487.6Standard non polar33892256
Dalamid,4TMS,isomer #56CSCCC(C(=O)N([Si](C)(C)C)[Si](C)(C)C)N(C(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C6958.5Standard polar33892256
Dalamid,4TMS,isomer #57CSCCC(C(=O)N([Si](C)(C)C)[Si](C)(C)C)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C4769.8Semi standard non polar33892256
Dalamid,4TMS,isomer #57CSCCC(C(=O)N([Si](C)(C)C)[Si](C)(C)C)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C4482.6Standard non polar33892256
Dalamid,4TMS,isomer #57CSCCC(C(=O)N([Si](C)(C)C)[Si](C)(C)C)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C6930.5Standard polar33892256
Dalamid,4TMS,isomer #58CSCCC(C(=O)N([Si](C)(C)C)[Si](C)(C)C)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C4765.6Semi standard non polar33892256
Dalamid,4TMS,isomer #58CSCCC(C(=O)N([Si](C)(C)C)[Si](C)(C)C)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C4489.3Standard non polar33892256
Dalamid,4TMS,isomer #58CSCCC(C(=O)N([Si](C)(C)C)[Si](C)(C)C)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C6814.0Standard polar33892256
Dalamid,4TMS,isomer #59CSCCC(C(=O)N[Si](C)(C)C)N(C(=O)C(CC1=CC=CC=C1)N(C(=O)CN(C(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4643.5Semi standard non polar33892256
Dalamid,4TMS,isomer #59CSCCC(C(=O)N[Si](C)(C)C)N(C(=O)C(CC1=CC=CC=C1)N(C(=O)CN(C(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4435.4Standard non polar33892256
Dalamid,4TMS,isomer #59CSCCC(C(=O)N[Si](C)(C)C)N(C(=O)C(CC1=CC=CC=C1)N(C(=O)CN(C(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C6922.2Standard polar33892256
Dalamid,4TMS,isomer #6CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O[Si](C)(C)C)C=C1)N[Si](C)(C)C)C(=O)N([Si](C)(C)C)[Si](C)(C)C4888.8Semi standard non polar33892256
Dalamid,4TMS,isomer #6CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O[Si](C)(C)C)C=C1)N[Si](C)(C)C)C(=O)N([Si](C)(C)C)[Si](C)(C)C4420.2Standard non polar33892256
Dalamid,4TMS,isomer #6CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O[Si](C)(C)C)C=C1)N[Si](C)(C)C)C(=O)N([Si](C)(C)C)[Si](C)(C)C6280.7Standard polar33892256
Dalamid,4TMS,isomer #60CSCCC(C(=O)N[Si](C)(C)C)N(C(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)N(C(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4642.2Semi standard non polar33892256
Dalamid,4TMS,isomer #60CSCCC(C(=O)N[Si](C)(C)C)N(C(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)N(C(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4447.6Standard non polar33892256
Dalamid,4TMS,isomer #60CSCCC(C(=O)N[Si](C)(C)C)N(C(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)N(C(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C6799.1Standard polar33892256
Dalamid,4TMS,isomer #61CSCCC(C(=O)N[Si](C)(C)C)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)N(C(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4627.7Semi standard non polar33892256
Dalamid,4TMS,isomer #61CSCCC(C(=O)N[Si](C)(C)C)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)N(C(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4448.3Standard non polar33892256
Dalamid,4TMS,isomer #61CSCCC(C(=O)N[Si](C)(C)C)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)N(C(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C6776.7Standard polar33892256
Dalamid,4TMS,isomer #62CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CN(C(=O)C(C)N(C(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(=O)N[Si](C)(C)C4669.8Semi standard non polar33892256
Dalamid,4TMS,isomer #62CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CN(C(=O)C(C)N(C(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(=O)N[Si](C)(C)C4463.5Standard non polar33892256
Dalamid,4TMS,isomer #62CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CN(C(=O)C(C)N(C(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(=O)N[Si](C)(C)C6807.2Standard polar33892256
Dalamid,4TMS,isomer #63CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CN(C(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(=O)N([Si](C)(C)C)[Si](C)(C)C4788.8Semi standard non polar33892256
Dalamid,4TMS,isomer #63CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CN(C(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(=O)N([Si](C)(C)C)[Si](C)(C)C4514.7Standard non polar33892256
Dalamid,4TMS,isomer #63CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CN(C(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(=O)N([Si](C)(C)C)[Si](C)(C)C6961.7Standard polar33892256
Dalamid,4TMS,isomer #64CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)N(C(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(=O)N([Si](C)(C)C)[Si](C)(C)C4780.6Semi standard non polar33892256
Dalamid,4TMS,isomer #64CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)N(C(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(=O)N([Si](C)(C)C)[Si](C)(C)C4532.0Standard non polar33892256
Dalamid,4TMS,isomer #64CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)N(C(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(=O)N([Si](C)(C)C)[Si](C)(C)C6831.6Standard polar33892256
Dalamid,4TMS,isomer #65CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)N(C(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(=O)N([Si](C)(C)C)[Si](C)(C)C4806.9Semi standard non polar33892256
Dalamid,4TMS,isomer #65CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)N(C(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(=O)N([Si](C)(C)C)[Si](C)(C)C4519.3Standard non polar33892256
Dalamid,4TMS,isomer #65CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)N(C(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(=O)N([Si](C)(C)C)[Si](C)(C)C6820.7Standard polar33892256
Dalamid,4TMS,isomer #66CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)N(C(=O)CN(C(=O)C(C)N(C(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4629.3Semi standard non polar33892256
Dalamid,4TMS,isomer #66CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)N(C(=O)CN(C(=O)C(C)N(C(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4411.1Standard non polar33892256
Dalamid,4TMS,isomer #66CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)N(C(=O)CN(C(=O)C(C)N(C(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C7363.2Standard polar33892256
Dalamid,4TMS,isomer #7CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O[Si](C)(C)C)C=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4720.3Semi standard non polar33892256
Dalamid,4TMS,isomer #7CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O[Si](C)(C)C)C=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4338.6Standard non polar33892256
Dalamid,4TMS,isomer #7CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O[Si](C)(C)C)C=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C6792.1Standard polar33892256
Dalamid,4TMS,isomer #8CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(CC1=CC=C(O[Si](C)(C)C)C=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4722.2Semi standard non polar33892256
Dalamid,4TMS,isomer #8CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(CC1=CC=C(O[Si](C)(C)C)C=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4325.1Standard non polar33892256
Dalamid,4TMS,isomer #8CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(CC1=CC=C(O[Si](C)(C)C)C=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C6744.1Standard polar33892256
Dalamid,4TMS,isomer #9CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(CC1=CC=C(O[Si](C)(C)C)C=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4721.9Semi standard non polar33892256
Dalamid,4TMS,isomer #9CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(CC1=CC=C(O[Si](C)(C)C)C=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4340.8Standard non polar33892256
Dalamid,4TMS,isomer #9CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(CC1=CC=C(O[Si](C)(C)C)C=C1)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C6743.1Standard polar33892256
Dalamid,1TBDMS,isomer #1CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O[Si](C)(C)C(C)(C)C)C=C1)C(N)=O5251.3Semi standard non polar33892256
Dalamid,1TBDMS,isomer #1CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O[Si](C)(C)C(C)(C)C)C=C1)C(N)=O4567.0Standard non polar33892256
Dalamid,1TBDMS,isomer #1CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O[Si](C)(C)C(C)(C)C)C=C1)C(N)=O8211.3Standard polar33892256
Dalamid,1TBDMS,isomer #2CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C(C)(C)C)C(N)=O5233.0Semi standard non polar33892256
Dalamid,1TBDMS,isomer #2CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C(C)(C)C)C(N)=O4609.2Standard non polar33892256
Dalamid,1TBDMS,isomer #2CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C(C)(C)C)C(N)=O8002.6Standard polar33892256
Dalamid,1TBDMS,isomer #3CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)C(=O)N[Si](C)(C)C(C)(C)C5215.9Semi standard non polar33892256
Dalamid,1TBDMS,isomer #3CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)C(=O)N[Si](C)(C)C(C)(C)C4574.2Standard non polar33892256
Dalamid,1TBDMS,isomer #3CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)C(=O)N[Si](C)(C)C(C)(C)C7932.3Standard polar33892256
Dalamid,1TBDMS,isomer #4CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C5143.8Semi standard non polar33892256
Dalamid,1TBDMS,isomer #4CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C4521.4Standard non polar33892256
Dalamid,1TBDMS,isomer #4CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C8385.4Standard polar33892256
Dalamid,1TBDMS,isomer #5CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C)C(N)=O5182.7Semi standard non polar33892256
Dalamid,1TBDMS,isomer #5CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C)C(N)=O4572.2Standard non polar33892256
Dalamid,1TBDMS,isomer #5CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C)C(N)=O8471.5Standard polar33892256
Dalamid,1TBDMS,isomer #6CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C)C(N)=O5198.1Semi standard non polar33892256
Dalamid,1TBDMS,isomer #6CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C)C(N)=O4567.8Standard non polar33892256
Dalamid,1TBDMS,isomer #6CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C)C(N)=O8452.1Standard polar33892256
Dalamid,1TBDMS,isomer #7CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C)C(N)=O5156.5Semi standard non polar33892256
Dalamid,1TBDMS,isomer #7CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C)C(N)=O4582.6Standard non polar33892256
Dalamid,1TBDMS,isomer #7CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C)C(N)=O8332.4Standard polar33892256
Dalamid,2TBDMS,isomer #1CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O[Si](C)(C)C(C)(C)C)C=C1)N[Si](C)(C)C(C)(C)C)C(N)=O5408.1Semi standard non polar33892256
Dalamid,2TBDMS,isomer #1CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O[Si](C)(C)C(C)(C)C)C=C1)N[Si](C)(C)C(C)(C)C)C(N)=O4716.3Standard non polar33892256
Dalamid,2TBDMS,isomer #1CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O[Si](C)(C)C(C)(C)C)C=C1)N[Si](C)(C)C(C)(C)C)C(N)=O7355.4Standard polar33892256
Dalamid,2TBDMS,isomer #10CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(N)=O5334.5Semi standard non polar33892256
Dalamid,2TBDMS,isomer #10CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(N)=O4736.0Standard non polar33892256
Dalamid,2TBDMS,isomer #10CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(N)=O7518.7Standard polar33892256
Dalamid,2TBDMS,isomer #11CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(N)=O5331.4Semi standard non polar33892256
Dalamid,2TBDMS,isomer #11CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(N)=O4740.3Standard non polar33892256
Dalamid,2TBDMS,isomer #11CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(N)=O7499.4Standard polar33892256
Dalamid,2TBDMS,isomer #12CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(N)=O5426.2Semi standard non polar33892256
Dalamid,2TBDMS,isomer #12CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(N)=O4773.9Standard non polar33892256
Dalamid,2TBDMS,isomer #12CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(N)=O7575.1Standard polar33892256
Dalamid,2TBDMS,isomer #13CSCCC(C(=O)N[Si](C)(C)C(C)(C)C)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C5253.3Semi standard non polar33892256
Dalamid,2TBDMS,isomer #13CSCCC(C(=O)N[Si](C)(C)C(C)(C)C)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C4677.2Standard non polar33892256
Dalamid,2TBDMS,isomer #13CSCCC(C(=O)N[Si](C)(C)C(C)(C)C)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C7410.8Standard polar33892256
Dalamid,2TBDMS,isomer #14CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C)C(=O)N[Si](C)(C)C(C)(C)C5305.9Semi standard non polar33892256
Dalamid,2TBDMS,isomer #14CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C)C(=O)N[Si](C)(C)C(C)(C)C4721.1Standard non polar33892256
Dalamid,2TBDMS,isomer #14CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C)C(=O)N[Si](C)(C)C(C)(C)C7426.4Standard polar33892256
Dalamid,2TBDMS,isomer #15CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C)C(=O)N[Si](C)(C)C(C)(C)C5307.9Semi standard non polar33892256
Dalamid,2TBDMS,isomer #15CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C)C(=O)N[Si](C)(C)C(C)(C)C4720.3Standard non polar33892256
Dalamid,2TBDMS,isomer #15CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C)C(=O)N[Si](C)(C)C(C)(C)C7421.8Standard polar33892256
Dalamid,2TBDMS,isomer #16CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C)C(=O)N[Si](C)(C)C(C)(C)C5286.0Semi standard non polar33892256
Dalamid,2TBDMS,isomer #16CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C)C(=O)N[Si](C)(C)C(C)(C)C4743.3Standard non polar33892256
Dalamid,2TBDMS,isomer #16CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C)C(=O)N[Si](C)(C)C(C)(C)C7285.7Standard polar33892256
Dalamid,2TBDMS,isomer #17CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)C(=O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C5361.3Semi standard non polar33892256
Dalamid,2TBDMS,isomer #17CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)C(=O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C4744.1Standard non polar33892256
Dalamid,2TBDMS,isomer #17CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)C(=O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C7442.7Standard polar33892256
Dalamid,2TBDMS,isomer #18CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C5219.6Semi standard non polar33892256
Dalamid,2TBDMS,isomer #18CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C4678.9Standard non polar33892256
Dalamid,2TBDMS,isomer #18CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C7914.4Standard polar33892256
Dalamid,2TBDMS,isomer #19CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C5233.2Semi standard non polar33892256
Dalamid,2TBDMS,isomer #19CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C4675.2Standard non polar33892256
Dalamid,2TBDMS,isomer #19CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C7887.0Standard polar33892256
Dalamid,2TBDMS,isomer #2CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O[Si](C)(C)C(C)(C)C)C=C1)C(=O)N[Si](C)(C)C(C)(C)C5387.4Semi standard non polar33892256
Dalamid,2TBDMS,isomer #2CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O[Si](C)(C)C(C)(C)C)C=C1)C(=O)N[Si](C)(C)C(C)(C)C4687.1Standard non polar33892256
Dalamid,2TBDMS,isomer #2CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O[Si](C)(C)C(C)(C)C)C=C1)C(=O)N[Si](C)(C)C(C)(C)C7252.8Standard polar33892256
Dalamid,2TBDMS,isomer #20CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C5222.9Semi standard non polar33892256
Dalamid,2TBDMS,isomer #20CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C4677.6Standard non polar33892256
Dalamid,2TBDMS,isomer #20CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C7784.7Standard polar33892256
Dalamid,2TBDMS,isomer #21CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CN(C(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(N)=O5259.2Semi standard non polar33892256
Dalamid,2TBDMS,isomer #21CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CN(C(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(N)=O4702.9Standard non polar33892256
Dalamid,2TBDMS,isomer #21CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CN(C(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(N)=O7979.3Standard polar33892256
Dalamid,2TBDMS,isomer #22CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)N(C(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(N)=O5258.9Semi standard non polar33892256
Dalamid,2TBDMS,isomer #22CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)N(C(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(N)=O4719.8Standard non polar33892256
Dalamid,2TBDMS,isomer #22CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)N(C(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(N)=O7865.7Standard polar33892256
Dalamid,2TBDMS,isomer #23CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)N(C(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(N)=O5228.2Semi standard non polar33892256
Dalamid,2TBDMS,isomer #23CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)N(C(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(N)=O4725.5Standard non polar33892256
Dalamid,2TBDMS,isomer #23CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)N(C(=O)C(N)CC1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(N)=O7864.0Standard polar33892256
Dalamid,2TBDMS,isomer #3CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O[Si](C)(C)C(C)(C)C)C=C1)[Si](C)(C)C(C)(C)C5327.0Semi standard non polar33892256
Dalamid,2TBDMS,isomer #3CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O[Si](C)(C)C(C)(C)C)C=C1)[Si](C)(C)C(C)(C)C4630.2Standard non polar33892256
Dalamid,2TBDMS,isomer #3CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O[Si](C)(C)C(C)(C)C)C=C1)[Si](C)(C)C(C)(C)C7705.0Standard polar33892256
Dalamid,2TBDMS,isomer #4CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O[Si](C)(C)C(C)(C)C)C=C1)[Si](C)(C)C(C)(C)C)C(N)=O5365.0Semi standard non polar33892256
Dalamid,2TBDMS,isomer #4CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O[Si](C)(C)C(C)(C)C)C=C1)[Si](C)(C)C(C)(C)C)C(N)=O4685.8Standard non polar33892256
Dalamid,2TBDMS,isomer #4CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O[Si](C)(C)C(C)(C)C)C=C1)[Si](C)(C)C(C)(C)C)C(N)=O7789.0Standard polar33892256
Dalamid,2TBDMS,isomer #5CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(N)CC1=CC=C(O[Si](C)(C)C(C)(C)C)C=C1)[Si](C)(C)C(C)(C)C)C(N)=O5368.5Semi standard non polar33892256
Dalamid,2TBDMS,isomer #5CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(N)CC1=CC=C(O[Si](C)(C)C(C)(C)C)C=C1)[Si](C)(C)C(C)(C)C)C(N)=O4669.2Standard non polar33892256
Dalamid,2TBDMS,isomer #5CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CN(C(=O)C(C)NC(=O)C(N)CC1=CC=C(O[Si](C)(C)C(C)(C)C)C=C1)[Si](C)(C)C(C)(C)C)C(N)=O7773.5Standard polar33892256
Dalamid,2TBDMS,isomer #6CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(N)CC1=CC=C(O[Si](C)(C)C(C)(C)C)C=C1)[Si](C)(C)C(C)(C)C)C(N)=O5343.7Semi standard non polar33892256
Dalamid,2TBDMS,isomer #6CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(N)CC1=CC=C(O[Si](C)(C)C(C)(C)C)C=C1)[Si](C)(C)C(C)(C)C)C(N)=O4679.2Standard non polar33892256
Dalamid,2TBDMS,isomer #6CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N(C(=O)C(N)CC1=CC=C(O[Si](C)(C)C(C)(C)C)C=C1)[Si](C)(C)C(C)(C)C)C(N)=O7671.3Standard polar33892256
Dalamid,2TBDMS,isomer #7CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C(C)(C)C)C(=O)N[Si](C)(C)C(C)(C)C5364.7Semi standard non polar33892256
Dalamid,2TBDMS,isomer #7CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C(C)(C)C)C(=O)N[Si](C)(C)C(C)(C)C4737.4Standard non polar33892256
Dalamid,2TBDMS,isomer #7CSCCC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C(C)(C)C)C(=O)N[Si](C)(C)C(C)(C)C6965.9Standard polar33892256
Dalamid,2TBDMS,isomer #8CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C5290.2Semi standard non polar33892256
Dalamid,2TBDMS,isomer #8CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C4694.9Standard non polar33892256
Dalamid,2TBDMS,isomer #8CSCCC(C(N)=O)N(C(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C7436.2Standard polar33892256
Dalamid,2TBDMS,isomer #9CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(N)=O5330.2Semi standard non polar33892256
Dalamid,2TBDMS,isomer #9CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(N)=O4742.0Standard non polar33892256
Dalamid,2TBDMS,isomer #9CSCCC(NC(=O)C(CC1=CC=CC=C1)N(C(=O)CNC(=O)C(C)NC(=O)C(CC1=CC=C(O)C=C1)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(N)=O7538.9Standard polar33892256
Spectra

MS/MS Spectra

Spectrum TypeDescriptionSplash KeyDeposition DateSourceView
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Dalamid 10V, Positive-QTOFsplash10-000i-0200190000-f6f0d57b775ee76e84712021-10-12Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Dalamid 20V, Positive-QTOFsplash10-0006-9544650000-26cffa81c0ed297ce13f2021-10-12Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Dalamid 40V, Positive-QTOFsplash10-03di-9500000000-3d7b3751c61a1e79d6792021-10-12Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Dalamid 10V, Negative-QTOFsplash10-000i-0000190000-ae4af96628c9c01f80292021-10-12Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Dalamid 20V, Negative-QTOFsplash10-0002-9632210000-a3b94d6039e4b103d48d2021-10-12Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Dalamid 40V, Negative-QTOFsplash10-0002-9700000000-12e4d9cba5fbbc648e982021-10-12Wishart LabView Spectrum
Biological Properties
Cellular LocationsNot Available
Biospecimen Locations
  • Blood
Tissue LocationsNot Available
Pathways
Normal Concentrations
BiospecimenStatusValueAgeSexConditionReferenceDetails
BloodDetected but not QuantifiedNot QuantifiedNot SpecifiedNot SpecifiedNormal details
Abnormal Concentrations
Not Available
Associated Disorders and Diseases
Disease ReferencesNone
Associated OMIM IDsNone
DrugBank IDNot Available
Phenol Explorer Compound IDNot Available
FooDB IDNot Available
KNApSAcK IDNot Available
Chemspider ID90523
KEGG Compound IDNot Available
BioCyc IDNot Available
BiGG IDNot Available
Wikipedia LinkNot Available
METLIN IDNot Available
PubChem Compound100169
PDB IDNot Available
ChEBI IDNot Available
Food Biomarker OntologyNot Available
VMH IDNot Available
MarkerDB IDNot Available
Good Scents IDNot Available
References
Synthesis ReferenceNot Available
Material Safety Data Sheet (MSDS)Not Available
General References
  1. Barupal DK, Fiehn O: Generating the Blood Exposome Database Using a Comprehensive Text Mining and Database Fusion Approach. Environ Health Perspect. 2019 Sep;127(9):97008. doi: 10.1289/EHP4713. Epub 2019 Sep 26. [PubMed:31557052 ]