Hmdb loader

Showing metabocard for 6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid (HMDB0248670)

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Record Information
Version5.0
StatusDetected but not Quantified
Creation Date2021-09-11 02:06:05 UTC
Update Date2021-09-26 22:59:04 UTC
HMDB IDHMDB0248670
Secondary Accession NumbersNone
Metabolite Identification
Common Name6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
Description6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, also known as N(4)-methyl-D-asparaginylamoxicillin, 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 6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid. This compound has been identified in human blood as reported by (PMID: 31557052 ). 6-[[2-[[2-amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid is not a naturally occurring metabolite and is only found in those individuals exposed to this compound or its derivatives. Technically 6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid is part of the human exposome. The exposome can be defined as the collection of all the exposures of an individual in a lifetime and how those exposures relate to health. An individual's exposure begins before birth and includes insults from environmental and occupational sources.
Structure
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MOL3D MOLSDF3D SDFPDB3D PDBSMILESInChI

MOL for HMDB0248670 (6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid)


  Mrv1652309112104062D          

 34 36  0  0  0  0            999 V2000
   -2.3895    2.1766    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9402    2.8685    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.8207    3.5955    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6071    2.7986    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
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3D MOL for HMDB0248670 (6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid)

HMDB0248671
     RDKit          3D
Aspoxicillin
 61 63  0  0  0  0  0  0  0  0999 V2000
   -7.5490    2.8491   -0.6454 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -6.1957    1.5685    1.3055 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7315    0.3253   -0.0977 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6958    0.9295   -1.0662 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.5478   -0.1301   -1.0350 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
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3D SDF for HMDB0248670 (6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid)


  Mrv1652309112104062D          

 34 36  0  0  0  0            999 V2000
   -2.3895    2.1766    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9402    2.8685    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6445    3.6387    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8207    3.5955    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6071    2.7986    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2990    2.3493    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.1898    3.0121    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0238    3.8090    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.9042    2.5996    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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 31 32  2  0  0  0  0
 31 33  1  0  0  0  0
  2 34  1  0  0  0  0
M  END
> <DATABASE_ID>
HMDB0248670

> <DATABASE_NAME>
hmdb

> <SMILES>
CNC(=O)CC(N)C(=O)NC(C(=O)NC1C2SC(C)(C)C(N2C1=O)C(O)=O)C1=CC=C(O)C=C1

> <INCHI_IDENTIFIER>
InChI=1S/C21H27N5O7S/c1-21(2)15(20(32)33)26-18(31)14(19(26)34-21)25-17(30)13(9-4-6-10(27)7-5-9)24-16(29)11(22)8-12(28)23-3/h4-7,11,13-15,19,27H,8,22H2,1-3H3,(H,23,28)(H,24,29)(H,25,30)(H,32,33)

> <INCHI_KEY>
BHELIUBJHYAEDK-UHFFFAOYSA-N

> <FORMULA>
C21H27N5O7S

> <MOLECULAR_WEIGHT>
493.54

> <EXACT_MASS>
493.163119403

> <JCHEM_ACCEPTOR_COUNT>
8

> <JCHEM_ATOM_COUNT>
61

> <JCHEM_AVERAGE_POLARIZABILITY>
48.845034660464364

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
6

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
6-{2-[2-amino-3-(methylcarbamoyl)propanamido]-2-(4-hydroxyphenyl)acetamido}-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid

> <ALOGPS_LOGP>
0.59

> <JCHEM_LOGP>
-4.067552559276732

> <ALOGPS_LOGS>
-2.98

> <JCHEM_MDDR_LIKE_RULE>
1

> <JCHEM_NUMBER_OF_RINGS>
3

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA>
9.474106662866012

> <JCHEM_PKA_STRONGEST_ACIDIC>
3.178765852508745

> <JCHEM_PKA_STRONGEST_BASIC>
7.043679202447018

> <JCHEM_POLAR_SURFACE_AREA>
191.16

> <JCHEM_REFRACTIVITY>
119.55609999999999

> <JCHEM_ROTATABLE_BOND_COUNT>
8

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
5.18e-01 g/l

> <JCHEM_TRADITIONAL_IUPAC>
6-{2-[2-amino-3-(methylcarbamoyl)propanamido]-2-(4-hydroxyphenyl)acetamido}-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid

> <JCHEM_VEBER_RULE>
0

$$$$
Download

3D-SDF for HMDB0248670 (6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid)

HMDB0248671
     RDKit          3D
Aspoxicillin
 61 63  0  0  0  0  0  0  0  0999 V2000
   -7.5490    2.8491   -0.6454 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4790    1.9411   -0.9476 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7928    1.2664    0.0906 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1957    1.5685    1.3055 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7315    0.3253   -0.0977 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6958    0.9295   -1.0662 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1685    2.1473   -0.5673 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5478   -0.1301   -1.0350 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3878   -0.7034   -2.1183 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9002   -0.2693    0.1702 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8704   -1.1157    0.6587 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4122   -0.6686    0.0318 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9469   -1.1978   -0.9586 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9985    0.4801    0.6913 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.1785    1.0933    0.4029 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3556    2.2218   -0.5418 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7690    3.1153   -1.1348 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7289    1.7923   -0.5004 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.0935    0.4845   -0.7354 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3006   -0.6330   -0.1270 S   0  0  0  0  0  0  0  0  0  0  0  0
    5.7220    0.5386   -0.2314 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6293    0.2468    0.9178 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4342    0.1986   -1.5539 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0943    1.8532   -0.3397 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4376    2.6431    0.9056 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5939    2.0530    1.9751 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5733    3.9991    0.8145 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1858   -2.5502    0.4963 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5368   -3.3025    1.6253 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9430   -4.6035    1.5686 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0246   -5.2445    0.3313 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4281   -6.5479    0.2156 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6917   -4.5555   -0.7881 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2775   -3.2267   -0.7030 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.4437    3.7540   -1.3083 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.5137    2.3630   -0.7538 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3470    3.2434    0.4061 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1816    1.7837   -1.9337 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0304   -0.6575   -0.4063 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1668    0.2122    0.8983 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0983    0.9979   -2.0873 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7651    2.7447   -1.3342 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6743    2.1423    0.3060 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2890    0.4296    0.9526 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7289   -0.9567    1.7512 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4064    0.9407    1.4933 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9346    1.1394    1.2775 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5888    0.3624   -1.6753 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.3967    0.9709    1.1520 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.0690   -0.1527    1.8220 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.2110   -0.6908    0.6067 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.7670    0.5460   -2.3589 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.3647    0.7711   -1.5815 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.5744   -0.8908   -1.6487 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5746    2.4470   -1.1651 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7617    4.6227    0.6353 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5021   -2.8087    2.5804 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2063   -5.1823    2.4284 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8236   -7.3294    0.2410 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7305   -5.0376   -1.7515 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0099   -2.7626   -1.6277 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  2  0
  3  5  1  0
  5  6  1  0
  6  7  1  0
  6  8  1  0
  8  9  2  0
  8 10  1  0
 10 11  1  0
 11 12  1  0
 12 13  2  0
 12 14  1  0
 14 15  1  0
 15 16  1  0
 16 17  2  0
 16 18  1  0
 18 19  1  0
 19 20  1  0
 20 21  1  0
 21 22  1  0
 21 23  1  0
 21 24  1  0
 24 25  1  0
 25 26  2  0
 25 27  1  0
 11 28  1  0
 28 29  2  0
 29 30  1  0
 30 31  2  0
 31 32  1  0
 31 33  1  0
 33 34  2  0
 19 15  1  0
 34 28  1  0
 24 18  1  0
  1 35  1  0
  1 36  1  0
  1 37  1  0
  2 38  1  0
  5 39  1  0
  5 40  1  0
  6 41  1  0
  7 42  1  0
  7 43  1  0
 10 44  1  0
 11 45  1  0
 14 46  1  0
 15 47  1  0
 19 48  1  0
 22 49  1  0
 22 50  1  0
 22 51  1  0
 23 52  1  0
 23 53  1  0
 23 54  1  0
 24 55  1  0
 27 56  1  0
 29 57  1  0
 30 58  1  0
 32 59  1  0
 33 60  1  0
 34 61  1  0
M  END
Download

PDB for HMDB0248670 (6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid)

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      -4.460   4.063   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0      -3.622   5.354   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0      -3.070   6.792   0.000  0.00  0.00           C+0
HETATM    4  N   UNK     0      -1.532   6.712   0.000  0.00  0.00           N+0
HETATM    5  C   UNK     0      -1.133   5.224   0.000  0.00  0.00           C+0
HETATM    6  S   UNK     0      -2.425   4.385   0.000  0.00  0.00           S+0
HETATM    7  C   UNK     0       0.354   5.623   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0      -0.044   7.110   0.000  0.00  0.00           C+0
HETATM    9  O   UNK     0       0.726   8.444   0.000  0.00  0.00           O+0
HETATM   10  N   UNK     0       1.688   4.853   0.000  0.00  0.00           N+0
HETATM   11  C   UNK     0       3.022   5.623   0.000  0.00  0.00           C+0
HETATM   12  O   UNK     0       3.022   7.163   0.000  0.00  0.00           O+0
HETATM   13  C   UNK     0       4.355   4.853   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0       4.355   3.313   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0       5.689   2.543   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0       5.689   1.003   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0       4.355   0.233   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0       3.022   1.003   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0       3.022   2.543   0.000  0.00  0.00           C+0
HETATM   20  O   UNK     0       4.355  -1.307   0.000  0.00  0.00           O+0
HETATM   21  N   UNK     0       5.689   5.623   0.000  0.00  0.00           N+0
HETATM   22  C   UNK     0       7.023   4.853   0.000  0.00  0.00           C+0
HETATM   23  O   UNK     0       7.023   3.313   0.000  0.00  0.00           O+0
HETATM   24  C   UNK     0       8.356   5.623   0.000  0.00  0.00           C+0
HETATM   25  C   UNK     0       9.690   4.853   0.000  0.00  0.00           C+0
HETATM   26  C   UNK     0      11.024   5.623   0.000  0.00  0.00           C+0
HETATM   27  O   UNK     0      11.024   7.163   0.000  0.00  0.00           O+0
HETATM   28  N   UNK     0      12.357   4.853   0.000  0.00  0.00           N+0
HETATM   29  C   UNK     0      13.691   5.623   0.000  0.00  0.00           C+0
HETATM   30  N   UNK     0       8.356   7.163   0.000  0.00  0.00           N+0
HETATM   31  C   UNK     0      -3.909   8.084   0.000  0.00  0.00           C+0
HETATM   32  O   UNK     0      -5.446   8.003   0.000  0.00  0.00           O+0
HETATM   33  O   UNK     0      -3.209   9.456   0.000  0.00  0.00           O+0
HETATM   34  C   UNK     0      -4.994   6.054   0.000  0.00  0.00           C+0
CONECT    1    2                                                            
CONECT    2    1    3    6   34                                             
CONECT    3    2    4   31                                                  
CONECT    4    3    5    8                                                  
CONECT    5    4    6    7                                                  
CONECT    6    5    2                                                       
CONECT    7    5    8   10                                                  
CONECT    8    7    4    9                                                  
CONECT    9    8                                                            
CONECT   10    7   11                                                       
CONECT   11   10   12   13                                                  
CONECT   12   11                                                            
CONECT   13   11   14   21                                                  
CONECT   14   13   15   19                                                  
CONECT   15   14   16                                                       
CONECT   16   15   17                                                       
CONECT   17   16   18   20                                                  
CONECT   18   17   19                                                       
CONECT   19   18   14                                                       
CONECT   20   17                                                            
CONECT   21   13   22                                                       
CONECT   22   21   23   24                                                  
CONECT   23   22                                                            
CONECT   24   22   25   30                                                  
CONECT   25   24   26                                                       
CONECT   26   25   27   28                                                  
CONECT   27   26                                                            
CONECT   28   26   29                                                       
CONECT   29   28                                                            
CONECT   30   24                                                            
CONECT   31    3   32   33                                                  
CONECT   32   31                                                            
CONECT   33   31                                                            
CONECT   34    2                                                            
MASTER        0    0    0    0    0    0    0    0   34    0   72    0
END
Download

3D PDB for HMDB0248670 (6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid)

COMPND    HMDB0248670
HETATM    1  C1  UNL     1      -7.037   4.710  -3.077  1.00  0.00           C  
HETATM    2  N1  UNL     1      -5.801   3.959  -2.985  1.00  0.00           N  
HETATM    3  C2  UNL     1      -5.722   2.769  -2.211  1.00  0.00           C  
HETATM    4  O1  UNL     1      -6.751   2.374  -1.599  1.00  0.00           O  
HETATM    5  C3  UNL     1      -4.438   2.025  -2.140  1.00  0.00           C  
HETATM    6  C4  UNL     1      -4.585   0.805  -1.267  1.00  0.00           C  
HETATM    7  N2  UNL     1      -4.966   1.226   0.051  1.00  0.00           N  
HETATM    8  C5  UNL     1      -3.341   0.007  -1.277  1.00  0.00           C  
HETATM    9  O2  UNL     1      -2.910  -0.414  -2.373  1.00  0.00           O  
HETATM   10  N3  UNL     1      -2.624  -0.296  -0.094  1.00  0.00           N  
HETATM   11  C6  UNL     1      -1.409  -1.074  -0.085  1.00  0.00           C  
HETATM   12  C7  UNL     1      -0.241  -0.247   0.370  1.00  0.00           C  
HETATM   13  O3  UNL     1      -0.392   0.963   0.684  1.00  0.00           O  
HETATM   14  N4  UNL     1       1.060  -0.796   0.462  1.00  0.00           N  
HETATM   15  C8  UNL     1       2.145   0.032   0.902  1.00  0.00           C  
HETATM   16  C9  UNL     1       2.908  -0.701   1.989  1.00  0.00           C  
HETATM   17  O4  UNL     1       2.462  -1.299   3.000  1.00  0.00           O  
HETATM   18  N5  UNL     1       4.159  -0.406   1.372  1.00  0.00           N  
HETATM   19  C10 UNL     1       3.433  -0.177   0.122  1.00  0.00           C  
HETATM   20  S1  UNL     1       4.265   1.346  -0.411  1.00  0.00           S  
HETATM   21  C11 UNL     1       5.732   1.229   0.655  1.00  0.00           C  
HETATM   22  C12 UNL     1       7.004   1.369  -0.139  1.00  0.00           C  
HETATM   23  C13 UNL     1       5.661   2.160   1.826  1.00  0.00           C  
HETATM   24  C14 UNL     1       5.562  -0.195   1.180  1.00  0.00           C  
HETATM   25  C15 UNL     1       6.098  -1.204   0.254  1.00  0.00           C  
HETATM   26  O5  UNL     1       5.364  -2.103  -0.181  1.00  0.00           O  
HETATM   27  O6  UNL     1       7.428  -1.201  -0.172  1.00  0.00           O  
HETATM   28  C16 UNL     1      -1.519  -2.311   0.710  1.00  0.00           C  
HETATM   29  C17 UNL     1      -1.029  -3.514   0.204  1.00  0.00           C  
HETATM   30  C18 UNL     1      -1.112  -4.696   0.916  1.00  0.00           C  
HETATM   31  C19 UNL     1      -1.693  -4.714   2.170  1.00  0.00           C  
HETATM   32  O7  UNL     1      -1.742  -5.940   2.830  1.00  0.00           O  
HETATM   33  C20 UNL     1      -2.181  -3.553   2.690  1.00  0.00           C  
HETATM   34  C21 UNL     1      -2.091  -2.374   1.965  1.00  0.00           C  
HETATM   35  H1  UNL     1      -7.205   5.182  -2.083  1.00  0.00           H  
HETATM   36  H2  UNL     1      -6.971   5.468  -3.871  1.00  0.00           H  
HETATM   37  H3  UNL     1      -7.909   4.062  -3.339  1.00  0.00           H  
HETATM   38  H4  UNL     1      -4.963   4.311  -3.504  1.00  0.00           H  
HETATM   39  H5  UNL     1      -3.675   2.727  -1.749  1.00  0.00           H  
HETATM   40  H6  UNL     1      -4.129   1.764  -3.169  1.00  0.00           H  
HETATM   41  H7  UNL     1      -5.436   0.208  -1.705  1.00  0.00           H  
HETATM   42  H8  UNL     1      -5.054   0.426   0.718  1.00  0.00           H  
HETATM   43  H9  UNL     1      -4.354   1.993   0.409  1.00  0.00           H  
HETATM   44  H10 UNL     1      -3.026   0.081   0.816  1.00  0.00           H  
HETATM   45  H11 UNL     1      -1.188  -1.352  -1.135  1.00  0.00           H  
HETATM   46  H12 UNL     1       1.271  -1.788   0.221  1.00  0.00           H  
HETATM   47  H13 UNL     1       1.924   1.069   1.149  1.00  0.00           H  
HETATM   48  H14 UNL     1       3.414  -0.986  -0.599  1.00  0.00           H  
HETATM   49  H15 UNL     1       7.136   2.444  -0.375  1.00  0.00           H  
HETATM   50  H16 UNL     1       6.840   0.852  -1.120  1.00  0.00           H  
HETATM   51  H17 UNL     1       7.883   1.017   0.400  1.00  0.00           H  
HETATM   52  H18 UNL     1       5.042   3.061   1.550  1.00  0.00           H  
HETATM   53  H19 UNL     1       5.190   1.700   2.728  1.00  0.00           H  
HETATM   54  H20 UNL     1       6.690   2.446   2.113  1.00  0.00           H  
HETATM   55  H21 UNL     1       6.090  -0.298   2.166  1.00  0.00           H  
HETATM   56  H22 UNL     1       8.075  -1.831   0.299  1.00  0.00           H  
HETATM   57  H23 UNL     1      -0.574  -3.502  -0.777  1.00  0.00           H  
HETATM   58  H24 UNL     1      -0.712  -5.594   0.466  1.00  0.00           H  
HETATM   59  H25 UNL     1      -0.929  -6.150   3.424  1.00  0.00           H  
HETATM   60  H26 UNL     1      -2.634  -3.599   3.681  1.00  0.00           H  
HETATM   61  H27 UNL     1      -2.489  -1.471   2.408  1.00  0.00           H  
CONECT    1    2   35   36   37
CONECT    2    3   38
CONECT    3    4    4    5
CONECT    5    6   39   40
CONECT    6    7    8   41
CONECT    7   42   43
CONECT    8    9    9   10
CONECT   10   11   44
CONECT   11   12   28   45
CONECT   12   13   13   14
CONECT   14   15   46
CONECT   15   16   19   47
CONECT   16   17   17   18
CONECT   18   19   24
CONECT   19   20   48
CONECT   20   21
CONECT   21   22   23   24
CONECT   22   49   50   51
CONECT   23   52   53   54
CONECT   24   25   55
CONECT   25   26   26   27
CONECT   27   56
CONECT   28   29   29   34
CONECT   29   30   57
CONECT   30   31   31   58
CONECT   31   32   33
CONECT   32   59
CONECT   33   34   34   60
CONECT   34   61
END
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SMILES for HMDB0248670 (6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid)

CNC(=O)CC(N)C(=O)NC(C(=O)NC1C2SC(C)(C)C(N2C1=O)C(O)=O)C1=CC=C(O)C=C1
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INCHI for HMDB0248670 (6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid)

InChI=1S/C21H27N5O7S/c1-21(2)15(20(32)33)26-18(31)14(19(26)34-21)25-17(30)13(9-4-6-10(27)7-5-9)24-16(29)11(22)8-12(28)23-3/h4-7,11,13-15,19,27H,8,22H2,1-3H3,(H,23,28)(H,24,29)(H,25,30)(H,32,33)
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View in JSmolView NMR AssignmentsView Stereo Labels
Synonyms
ValueSource
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylateGenerator
N(4)-Methyl-D-asparaginylamoxicillinMeSH
Chemical FormulaC21H27N5O7S
Average Molecular Weight493.54
Monoisotopic Molecular Weight493.163119403
IUPAC Name6-{2-[2-amino-3-(methylcarbamoyl)propanamido]-2-(4-hydroxyphenyl)acetamido}-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
Traditional Name6-{2-[2-amino-3-(methylcarbamoyl)propanamido]-2-(4-hydroxyphenyl)acetamido}-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
CAS Registry NumberNot Available
SMILES
CNC(=O)CC(N)C(=O)NC(C(=O)NC1C2SC(C)(C)C(N2C1=O)C(O)=O)C1=CC=C(O)C=C1
InChI Identifier
InChI=1S/C21H27N5O7S/c1-21(2)15(20(32)33)26-18(31)14(19(26)34-21)25-17(30)13(9-4-6-10(27)7-5-9)24-16(29)11(22)8-12(28)23-3/h4-7,11,13-15,19,27H,8,22H2,1-3H3,(H,23,28)(H,24,29)(H,25,30)(H,32,33)
InChI KeyBHELIUBJHYAEDK-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
  • Penicillin
  • Asparagine or derivatives
  • N-acyl-alpha amino acid or derivatives
  • Alpha-amino acid amide
  • N-substituted-alpha-amino acid
  • Alpha-amino acid or derivatives
  • Phenylacetamide
  • Penam
  • 1-hydroxy-2-unsubstituted benzenoid
  • Phenol
  • Monocyclic benzene moiety
  • Fatty amide
  • N-acyl-amine
  • Fatty acyl
  • Benzenoid
  • Thiazolidine
  • Tertiary carboxylic acid amide
  • Beta-lactam
  • Secondary carboxylic acid amide
  • Amino acid
  • Amino acid or derivatives
  • Azetidine
  • Carboxamide group
  • Lactam
  • Thioether
  • Organoheterocyclic compound
  • Azacycle
  • Dialkylthioether
  • Hemithioaminal
  • Monocarboxylic acid or derivatives
  • Carboxylic acid
  • Primary amine
  • Organic oxygen compound
  • Primary aliphatic amine
  • Carbonyl group
  • Organopnictogen compound
  • Organic nitrogen compound
  • Organic oxide
  • Organonitrogen compound
  • Amine
  • Organooxygen compound
  • Hydrocarbon derivative
  • Aromatic heteropolycyclic compound
Molecular FrameworkAromatic heteropolycyclic 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
logP0.59ALOGPS
logP-4.1ChemAxon
logS-3ALOGPS
pKa (Strongest Acidic)3.18ChemAxon
pKa (Strongest Basic)7.04ChemAxon
Physiological Charge0ChemAxon
Hydrogen Acceptor Count8ChemAxon
Hydrogen Donor Count6ChemAxon
Polar Surface Area191.16 ŲChemAxon
Rotatable Bond Count8ChemAxon
Refractivity119.56 m³·mol⁻¹ChemAxon
Polarizability48.85 ųChemAxon
Number of Rings3ChemAxon
BioavailabilityYesChemAxon
Rule of FiveNoChemAxon
Ghose FilterNoChemAxon
Veber's RuleNoChemAxon
MDDR-like RuleYesChemAxon
Predicted Chromatographic Properties

Predicted Collision Cross Sections

PredictorAdduct TypeCCS Value (Å2)Reference
DeepCCS[M+H]+216.58130932474
DeepCCS[M-H]-214.18530932474
DeepCCS[M-2H]-247.06830932474
DeepCCS[M+Na]+222.49330932474
AllCCS[M+H]+206.932859911
AllCCS[M+H-H2O]+205.432859911
AllCCS[M+NH4]+208.232859911
AllCCS[M+Na]+208.532859911
AllCCS[M-H]-202.132859911
AllCCS[M+Na-2H]-203.132859911
AllCCS[M+HCOO]-204.332859911

Predicted Kovats Retention Indices

Derivatized

Derivative Name / StructureSMILESKovats RI ValueColumn TypeReference
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,1TMS,isomer #1CNC(=O)CC(N)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)C1=CC=C(O)C=C14036.2Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,1TMS,isomer #1CNC(=O)CC(N)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)C1=CC=C(O)C=C13808.3Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,1TMS,isomer #1CNC(=O)CC(N)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)C1=CC=C(O)C=C16793.8Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,1TMS,isomer #2CNC(=O)CC(N)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O[Si](C)(C)C)C=C14191.4Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,1TMS,isomer #2CNC(=O)CC(N)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O[Si](C)(C)C)C=C13809.8Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,1TMS,isomer #2CNC(=O)CC(N)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O[Si](C)(C)C)C=C16553.8Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,1TMS,isomer #3CNC(=O)CC(N[Si](C)(C)C)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O)C=C14190.7Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,1TMS,isomer #3CNC(=O)CC(N[Si](C)(C)C)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O)C=C13856.6Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,1TMS,isomer #3CNC(=O)CC(N[Si](C)(C)C)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O)C=C16440.2Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,1TMS,isomer #4CN(C(=O)CC(N)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O)C=C1)[Si](C)(C)C4215.2Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,1TMS,isomer #4CN(C(=O)CC(N)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O)C=C1)[Si](C)(C)C3854.3Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,1TMS,isomer #4CN(C(=O)CC(N)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O)C=C1)[Si](C)(C)C6879.8Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,1TMS,isomer #5CNC(=O)CC(N)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O)C=C1)[Si](C)(C)C4063.5Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,1TMS,isomer #5CNC(=O)CC(N)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O)C=C1)[Si](C)(C)C3806.6Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,1TMS,isomer #5CNC(=O)CC(N)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O)C=C1)[Si](C)(C)C6685.7Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,1TMS,isomer #6CNC(=O)CC(N)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C)C1=CC=C(O)C=C14109.7Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,1TMS,isomer #6CNC(=O)CC(N)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C)C1=CC=C(O)C=C13794.0Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,1TMS,isomer #6CNC(=O)CC(N)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C)C1=CC=C(O)C=C16791.6Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TMS,isomer #1CNC(=O)CC(N)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C14070.4Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TMS,isomer #1CNC(=O)CC(N)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C13818.1Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TMS,isomer #1CNC(=O)CC(N)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C16133.7Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TMS,isomer #10CN(C(=O)CC(N[Si](C)(C)C)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O)C=C1)[Si](C)(C)C4167.4Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TMS,isomer #10CN(C(=O)CC(N[Si](C)(C)C)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O)C=C1)[Si](C)(C)C3914.7Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TMS,isomer #10CN(C(=O)CC(N[Si](C)(C)C)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O)C=C1)[Si](C)(C)C5985.6Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TMS,isomer #11CNC(=O)CC(C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O)C=C1)N([Si](C)(C)C)[Si](C)(C)C4216.6Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TMS,isomer #11CNC(=O)CC(C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O)C=C1)N([Si](C)(C)C)[Si](C)(C)C3982.0Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TMS,isomer #11CNC(=O)CC(C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O)C=C1)N([Si](C)(C)C)[Si](C)(C)C6034.8Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TMS,isomer #12CNC(=O)CC(N[Si](C)(C)C)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O)C=C1)[Si](C)(C)C4050.9Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TMS,isomer #12CNC(=O)CC(N[Si](C)(C)C)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O)C=C1)[Si](C)(C)C3864.4Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TMS,isomer #12CNC(=O)CC(N[Si](C)(C)C)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O)C=C1)[Si](C)(C)C5942.3Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TMS,isomer #13CNC(=O)CC(N[Si](C)(C)C)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C)C1=CC=C(O)C=C14092.0Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TMS,isomer #13CNC(=O)CC(N[Si](C)(C)C)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C)C1=CC=C(O)C=C13867.8Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TMS,isomer #13CNC(=O)CC(N[Si](C)(C)C)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C)C1=CC=C(O)C=C15840.8Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TMS,isomer #14CN(C(=O)CC(N)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C4026.2Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TMS,isomer #14CN(C(=O)CC(N)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C3883.0Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TMS,isomer #14CN(C(=O)CC(N)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C6262.7Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TMS,isomer #15CN(C(=O)CC(N)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C4086.5Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TMS,isomer #15CN(C(=O)CC(N)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C3868.0Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TMS,isomer #15CN(C(=O)CC(N)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C6343.2Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TMS,isomer #16CNC(=O)CC(N)C(=O)N(C(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C3963.5Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TMS,isomer #16CNC(=O)CC(N)C(=O)N(C(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C3843.0Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TMS,isomer #16CNC(=O)CC(N)C(=O)N(C(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C6162.3Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TMS,isomer #2CNC(=O)CC(N[Si](C)(C)C)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)C1=CC=C(O)C=C14037.4Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TMS,isomer #2CNC(=O)CC(N[Si](C)(C)C)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)C1=CC=C(O)C=C13862.1Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TMS,isomer #2CNC(=O)CC(N[Si](C)(C)C)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)C1=CC=C(O)C=C15854.4Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TMS,isomer #3CN(C(=O)CC(N)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C4041.4Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TMS,isomer #3CN(C(=O)CC(N)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C3871.5Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TMS,isomer #3CN(C(=O)CC(N)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C6364.8Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TMS,isomer #4CNC(=O)CC(N)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C3905.6Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TMS,isomer #4CNC(=O)CC(N)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C3826.5Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TMS,isomer #4CNC(=O)CC(N)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C6168.9Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TMS,isomer #5CNC(=O)CC(N)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)[Si](C)(C)C)C1=CC=C(O)C=C13975.0Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TMS,isomer #5CNC(=O)CC(N)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)[Si](C)(C)C)C1=CC=C(O)C=C13815.5Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TMS,isomer #5CNC(=O)CC(N)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)[Si](C)(C)C)C1=CC=C(O)C=C16224.5Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TMS,isomer #6CNC(=O)CC(N[Si](C)(C)C)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O[Si](C)(C)C)C=C14172.7Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TMS,isomer #6CNC(=O)CC(N[Si](C)(C)C)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O[Si](C)(C)C)C=C13855.0Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TMS,isomer #6CNC(=O)CC(N[Si](C)(C)C)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O[Si](C)(C)C)C=C15763.8Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TMS,isomer #7CN(C(=O)CC(N)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C4193.1Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TMS,isomer #7CN(C(=O)CC(N)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C3876.7Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TMS,isomer #7CN(C(=O)CC(N)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C6211.8Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TMS,isomer #8CNC(=O)CC(N)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C4068.1Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TMS,isomer #8CNC(=O)CC(N)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C3824.1Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TMS,isomer #8CNC(=O)CC(N)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C5984.3Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TMS,isomer #9CNC(=O)CC(N)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C14111.0Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TMS,isomer #9CNC(=O)CC(N)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C13815.3Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TMS,isomer #9CNC(=O)CC(N)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C16110.4Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TMS,isomer #1CNC(=O)CC(N[Si](C)(C)C)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C14070.8Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TMS,isomer #1CNC(=O)CC(N[Si](C)(C)C)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C13848.7Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TMS,isomer #1CNC(=O)CC(N[Si](C)(C)C)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C15355.6Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TMS,isomer #10CN(C(=O)CC(N)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)[Si](C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C3934.4Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TMS,isomer #10CN(C(=O)CC(N)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)[Si](C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C3886.8Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TMS,isomer #10CN(C(=O)CC(N)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)[Si](C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C5877.0Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TMS,isomer #11CNC(=O)CC(N)C(=O)N(C(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)[Si](C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C3841.4Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TMS,isomer #11CNC(=O)CC(N)C(=O)N(C(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)[Si](C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C3857.6Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TMS,isomer #11CNC(=O)CC(N)C(=O)N(C(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)[Si](C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C5692.4Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TMS,isomer #12CN(C(=O)CC(N[Si](C)(C)C)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C4159.1Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TMS,isomer #12CN(C(=O)CC(N[Si](C)(C)C)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C3915.9Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TMS,isomer #12CN(C(=O)CC(N[Si](C)(C)C)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C5472.9Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TMS,isomer #13CNC(=O)CC(C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O[Si](C)(C)C)C=C1)N([Si](C)(C)C)[Si](C)(C)C4225.8Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TMS,isomer #13CNC(=O)CC(C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O[Si](C)(C)C)C=C1)N([Si](C)(C)C)[Si](C)(C)C3981.6Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TMS,isomer #13CNC(=O)CC(C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O[Si](C)(C)C)C=C1)N([Si](C)(C)C)[Si](C)(C)C5509.3Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TMS,isomer #14CNC(=O)CC(N[Si](C)(C)C)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C4062.4Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TMS,isomer #14CNC(=O)CC(N[Si](C)(C)C)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C3872.2Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TMS,isomer #14CNC(=O)CC(N[Si](C)(C)C)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C5388.1Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TMS,isomer #15CNC(=O)CC(N[Si](C)(C)C)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C14089.3Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TMS,isomer #15CNC(=O)CC(N[Si](C)(C)C)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C13864.1Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TMS,isomer #15CNC(=O)CC(N[Si](C)(C)C)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C15343.2Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TMS,isomer #16CN(C(=O)CC(N)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)[Si](C)(C)C4041.7Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TMS,isomer #16CN(C(=O)CC(N)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)[Si](C)(C)C3896.8Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TMS,isomer #16CN(C(=O)CC(N)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)[Si](C)(C)C5720.1Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TMS,isomer #17CN(C(=O)CC(N)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C4080.1Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TMS,isomer #17CN(C(=O)CC(N)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C3890.3Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TMS,isomer #17CN(C(=O)CC(N)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C5821.7Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TMS,isomer #18CNC(=O)CC(N)C(=O)N(C(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C3990.9Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TMS,isomer #18CNC(=O)CC(N)C(=O)N(C(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C3853.9Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TMS,isomer #18CNC(=O)CC(N)C(=O)N(C(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C5619.2Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TMS,isomer #19CN(C(=O)CC(C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O)C=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4216.5Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TMS,isomer #19CN(C(=O)CC(C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O)C=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4048.7Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TMS,isomer #19CN(C(=O)CC(C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O)C=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C5666.4Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TMS,isomer #2CN(C(=O)CC(N)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C4050.4Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TMS,isomer #2CN(C(=O)CC(N)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C3882.8Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TMS,isomer #2CN(C(=O)CC(N)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C5844.2Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TMS,isomer #20CN(C(=O)CC(N[Si](C)(C)C)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C4010.2Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TMS,isomer #20CN(C(=O)CC(N[Si](C)(C)C)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C3950.0Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TMS,isomer #20CN(C(=O)CC(N[Si](C)(C)C)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C5576.9Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TMS,isomer #21CN(C(=O)CC(N[Si](C)(C)C)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C4051.2Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TMS,isomer #21CN(C(=O)CC(N[Si](C)(C)C)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C3940.6Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TMS,isomer #21CN(C(=O)CC(N[Si](C)(C)C)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C5485.9Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TMS,isomer #22CNC(=O)CC(C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O)C=C1)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C4133.5Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TMS,isomer #22CNC(=O)CC(C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O)C=C1)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C4001.5Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TMS,isomer #22CNC(=O)CC(C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O)C=C1)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C5618.0Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TMS,isomer #23CNC(=O)CC(C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C)C1=CC=C(O)C=C1)N([Si](C)(C)C)[Si](C)(C)C4154.2Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TMS,isomer #23CNC(=O)CC(C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C)C1=CC=C(O)C=C1)N([Si](C)(C)C)[Si](C)(C)C4014.1Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TMS,isomer #23CNC(=O)CC(C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C)C1=CC=C(O)C=C1)N([Si](C)(C)C)[Si](C)(C)C5525.5Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TMS,isomer #24CNC(=O)CC(N[Si](C)(C)C)C(=O)N(C(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C3974.2Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TMS,isomer #24CNC(=O)CC(N[Si](C)(C)C)C(=O)N(C(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C3922.1Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TMS,isomer #24CNC(=O)CC(N[Si](C)(C)C)C(=O)N(C(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C5425.9Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TMS,isomer #25CN(C(=O)CC(N)C(=O)N(C(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C3928.8Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TMS,isomer #25CN(C(=O)CC(N)C(=O)N(C(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C3931.1Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TMS,isomer #25CN(C(=O)CC(N)C(=O)N(C(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C5833.8Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TMS,isomer #3CNC(=O)CC(N)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C3951.1Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TMS,isomer #3CNC(=O)CC(N)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C3825.2Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TMS,isomer #3CNC(=O)CC(N)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C5630.4Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TMS,isomer #4CNC(=O)CC(N)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C14014.7Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TMS,isomer #4CNC(=O)CC(N)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C13814.5Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TMS,isomer #4CNC(=O)CC(N)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C15705.7Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TMS,isomer #5CN(C(=O)CC(N[Si](C)(C)C)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C4023.6Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TMS,isomer #5CN(C(=O)CC(N[Si](C)(C)C)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C3924.2Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TMS,isomer #5CN(C(=O)CC(N[Si](C)(C)C)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C5496.1Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TMS,isomer #6CNC(=O)CC(C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)C1=CC=C(O)C=C1)N([Si](C)(C)C)[Si](C)(C)C4082.0Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TMS,isomer #6CNC(=O)CC(C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)C1=CC=C(O)C=C1)N([Si](C)(C)C)[Si](C)(C)C3999.6Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TMS,isomer #6CNC(=O)CC(C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)C1=CC=C(O)C=C1)N([Si](C)(C)C)[Si](C)(C)C5536.3Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TMS,isomer #7CNC(=O)CC(N[Si](C)(C)C)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C3923.2Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TMS,isomer #7CNC(=O)CC(N[Si](C)(C)C)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C3880.1Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TMS,isomer #7CNC(=O)CC(N[Si](C)(C)C)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C5442.3Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TMS,isomer #8CNC(=O)CC(N[Si](C)(C)C)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)[Si](C)(C)C)C1=CC=C(O)C=C13976.1Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TMS,isomer #8CNC(=O)CC(N[Si](C)(C)C)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)[Si](C)(C)C)C1=CC=C(O)C=C13869.5Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TMS,isomer #8CNC(=O)CC(N[Si](C)(C)C)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)[Si](C)(C)C)C1=CC=C(O)C=C15299.9Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TMS,isomer #9CN(C(=O)CC(N)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C3876.9Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TMS,isomer #9CN(C(=O)CC(N)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C3897.6Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TMS,isomer #9CN(C(=O)CC(N)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C5843.3Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,4TMS,isomer #1CN(C(=O)CC(N[Si](C)(C)C)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C4035.6Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,4TMS,isomer #1CN(C(=O)CC(N[Si](C)(C)C)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C3914.5Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,4TMS,isomer #1CN(C(=O)CC(N[Si](C)(C)C)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C5108.0Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,4TMS,isomer #10CN(C(=O)CC(N[Si](C)(C)C)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)[Si](C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C3946.4Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,4TMS,isomer #10CN(C(=O)CC(N[Si](C)(C)C)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)[Si](C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C3947.6Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,4TMS,isomer #10CN(C(=O)CC(N[Si](C)(C)C)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)[Si](C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C5033.3Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,4TMS,isomer #11CNC(=O)CC(C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C4015.2Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,4TMS,isomer #11CNC(=O)CC(C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C4012.5Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,4TMS,isomer #11CNC(=O)CC(C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C5197.1Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,4TMS,isomer #12CNC(=O)CC(C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)[Si](C)(C)C)C1=CC=C(O)C=C1)N([Si](C)(C)C)[Si](C)(C)C4062.5Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,4TMS,isomer #12CNC(=O)CC(C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)[Si](C)(C)C)C1=CC=C(O)C=C1)N([Si](C)(C)C)[Si](C)(C)C4020.5Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,4TMS,isomer #12CNC(=O)CC(C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)[Si](C)(C)C)C1=CC=C(O)C=C1)N([Si](C)(C)C)[Si](C)(C)C5069.0Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,4TMS,isomer #13CNC(=O)CC(N[Si](C)(C)C)C(=O)N(C(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)[Si](C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C3877.7Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,4TMS,isomer #13CNC(=O)CC(N[Si](C)(C)C)C(=O)N(C(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)[Si](C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C3932.3Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,4TMS,isomer #13CNC(=O)CC(N[Si](C)(C)C)C(=O)N(C(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)[Si](C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C4971.2Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,4TMS,isomer #14CN(C(=O)CC(N)C(=O)N(C(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)[Si](C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C3827.0Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,4TMS,isomer #14CN(C(=O)CC(N)C(=O)N(C(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)[Si](C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C3943.9Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,4TMS,isomer #14CN(C(=O)CC(N)C(=O)N(C(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)[Si](C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C5450.7Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,4TMS,isomer #15CN(C(=O)CC(C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O[Si](C)(C)C)C=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4228.0Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,4TMS,isomer #15CN(C(=O)CC(C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O[Si](C)(C)C)C=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4047.2Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,4TMS,isomer #15CN(C(=O)CC(C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O[Si](C)(C)C)C=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C5264.5Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,4TMS,isomer #16CN(C(=O)CC(N[Si](C)(C)C)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)[Si](C)(C)C4040.9Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,4TMS,isomer #16CN(C(=O)CC(N[Si](C)(C)C)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)[Si](C)(C)C3952.8Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,4TMS,isomer #16CN(C(=O)CC(N[Si](C)(C)C)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)[Si](C)(C)C5154.1Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,4TMS,isomer #17CN(C(=O)CC(N[Si](C)(C)C)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C4063.2Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,4TMS,isomer #17CN(C(=O)CC(N[Si](C)(C)C)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C3942.6Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,4TMS,isomer #17CN(C(=O)CC(N[Si](C)(C)C)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C5112.8Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,4TMS,isomer #18CNC(=O)CC(C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C4162.6Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,4TMS,isomer #18CNC(=O)CC(C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C3993.4Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,4TMS,isomer #18CNC(=O)CC(C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C5189.6Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,4TMS,isomer #19CNC(=O)CC(C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C1)N([Si](C)(C)C)[Si](C)(C)C4187.4Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,4TMS,isomer #19CNC(=O)CC(C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C1)N([Si](C)(C)C)[Si](C)(C)C4006.0Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,4TMS,isomer #19CNC(=O)CC(C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C1)N([Si](C)(C)C)[Si](C)(C)C5145.3Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,4TMS,isomer #2CNC(=O)CC(C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C1)N([Si](C)(C)C)[Si](C)(C)C4112.0Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,4TMS,isomer #2CNC(=O)CC(C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C1)N([Si](C)(C)C)[Si](C)(C)C3975.3Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,4TMS,isomer #2CNC(=O)CC(C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C1)N([Si](C)(C)C)[Si](C)(C)C5143.4Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,4TMS,isomer #20CNC(=O)CC(N[Si](C)(C)C)C(=O)N(C(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C4002.3Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,4TMS,isomer #20CNC(=O)CC(N[Si](C)(C)C)C(=O)N(C(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C3923.9Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,4TMS,isomer #20CNC(=O)CC(N[Si](C)(C)C)C(=O)N(C(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C5031.6Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,4TMS,isomer #21CN(C(=O)CC(N)C(=O)N(C(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)[Si](C)(C)C3972.7Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,4TMS,isomer #21CN(C(=O)CC(N)C(=O)N(C(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)[Si](C)(C)C3937.3Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,4TMS,isomer #21CN(C(=O)CC(N)C(=O)N(C(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)[Si](C)(C)C5422.8Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,4TMS,isomer #22CN(C(=O)CC(C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O)C=C1)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4127.0Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,4TMS,isomer #22CN(C(=O)CC(C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O)C=C1)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4085.9Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,4TMS,isomer #22CN(C(=O)CC(C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O)C=C1)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C5334.3Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,4TMS,isomer #23CN(C(=O)CC(C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C)C1=CC=C(O)C=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4159.8Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,4TMS,isomer #23CN(C(=O)CC(C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C)C1=CC=C(O)C=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4089.7Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,4TMS,isomer #23CN(C(=O)CC(C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C)C1=CC=C(O)C=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C5252.5Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,4TMS,isomer #24CN(C(=O)CC(N[Si](C)(C)C)C(=O)N(C(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C3939.7Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,4TMS,isomer #24CN(C(=O)CC(N[Si](C)(C)C)C(=O)N(C(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C4014.6Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,4TMS,isomer #24CN(C(=O)CC(N[Si](C)(C)C)C(=O)N(C(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C5155.8Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,4TMS,isomer #25CNC(=O)CC(C(=O)N(C(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C4094.4Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,4TMS,isomer #25CNC(=O)CC(C(=O)N(C(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C4064.5Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,4TMS,isomer #25CNC(=O)CC(C(=O)N(C(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C5197.8Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,4TMS,isomer #3CNC(=O)CC(N[Si](C)(C)C)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C3957.7Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,4TMS,isomer #3CNC(=O)CC(N[Si](C)(C)C)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C3877.1Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,4TMS,isomer #3CNC(=O)CC(N[Si](C)(C)C)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C5020.7Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,4TMS,isomer #4CNC(=O)CC(N[Si](C)(C)C)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C14009.0Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,4TMS,isomer #4CNC(=O)CC(N[Si](C)(C)C)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C13864.2Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,4TMS,isomer #4CNC(=O)CC(N[Si](C)(C)C)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C14936.6Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,4TMS,isomer #5CN(C(=O)CC(N)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)[Si](C)(C)C3952.2Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,4TMS,isomer #5CN(C(=O)CC(N)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)[Si](C)(C)C3894.1Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,4TMS,isomer #5CN(C(=O)CC(N)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)[Si](C)(C)C5424.6Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,4TMS,isomer #6CN(C(=O)CC(N)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C3985.8Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,4TMS,isomer #6CN(C(=O)CC(N)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C3895.0Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,4TMS,isomer #6CN(C(=O)CC(N)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C5480.2Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,4TMS,isomer #7CNC(=O)CC(N)C(=O)N(C(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C3926.9Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,4TMS,isomer #7CNC(=O)CC(N)C(=O)N(C(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C3854.9Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,4TMS,isomer #7CNC(=O)CC(N)C(=O)N(C(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C5293.1Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,4TMS,isomer #8CN(C(=O)CC(C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)C1=CC=C(O)C=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4095.0Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,4TMS,isomer #8CN(C(=O)CC(C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)C1=CC=C(O)C=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4062.8Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,4TMS,isomer #8CN(C(=O)CC(C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)C1=CC=C(O)C=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C5247.1Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,4TMS,isomer #9CN(C(=O)CC(N[Si](C)(C)C)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C3896.3Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,4TMS,isomer #9CN(C(=O)CC(N[Si](C)(C)C)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C3961.5Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,4TMS,isomer #9CN(C(=O)CC(N[Si](C)(C)C)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C5156.4Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,5TMS,isomer #1CN(C(=O)CC(C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4115.7Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,5TMS,isomer #1CN(C(=O)CC(C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4047.5Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,5TMS,isomer #1CN(C(=O)CC(C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4907.7Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,5TMS,isomer #10CN(C(=O)CC(N[Si](C)(C)C)C(=O)N(C(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)[Si](C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C3859.1Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,5TMS,isomer #10CN(C(=O)CC(N[Si](C)(C)C)C(=O)N(C(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)[Si](C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C4031.9Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,5TMS,isomer #10CN(C(=O)CC(N[Si](C)(C)C)C(=O)N(C(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)[Si](C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C)[Si](C)(C)C4752.0Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,5TMS,isomer #11CNC(=O)CC(C(=O)N(C(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)[Si](C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C4014.7Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,5TMS,isomer #11CNC(=O)CC(C(=O)N(C(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)[Si](C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C4072.9Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,5TMS,isomer #11CNC(=O)CC(C(=O)N(C(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)[Si](C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C4776.0Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,5TMS,isomer #12CN(C(=O)CC(C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4176.0Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,5TMS,isomer #12CN(C(=O)CC(C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4075.4Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,5TMS,isomer #12CN(C(=O)CC(C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4968.9Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,5TMS,isomer #13CN(C(=O)CC(C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4182.7Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,5TMS,isomer #13CN(C(=O)CC(C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4088.2Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,5TMS,isomer #13CN(C(=O)CC(C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4926.7Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,5TMS,isomer #14CN(C(=O)CC(N[Si](C)(C)C)C(=O)N(C(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)[Si](C)(C)C3977.1Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,5TMS,isomer #14CN(C(=O)CC(N[Si](C)(C)C)C(=O)N(C(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)[Si](C)(C)C4017.7Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,5TMS,isomer #14CN(C(=O)CC(N[Si](C)(C)C)C(=O)N(C(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)[Si](C)(C)C4828.5Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,5TMS,isomer #15CNC(=O)CC(C(=O)N(C(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C4139.1Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,5TMS,isomer #15CNC(=O)CC(C(=O)N(C(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C4052.6Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,5TMS,isomer #15CNC(=O)CC(C(=O)N(C(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C4849.7Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,5TMS,isomer #16CN(C(=O)CC(C(=O)N(C(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4107.2Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,5TMS,isomer #16CN(C(=O)CC(C(=O)N(C(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4157.3Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,5TMS,isomer #16CN(C(=O)CC(C(=O)N(C(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4982.4Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,5TMS,isomer #2CN(C(=O)CC(N[Si](C)(C)C)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)[Si](C)(C)C3958.3Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,5TMS,isomer #2CN(C(=O)CC(N[Si](C)(C)C)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)[Si](C)(C)C3959.2Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,5TMS,isomer #2CN(C(=O)CC(N[Si](C)(C)C)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)[Si](C)(C)C4805.5Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,5TMS,isomer #3CN(C(=O)CC(N[Si](C)(C)C)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C3988.2Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,5TMS,isomer #3CN(C(=O)CC(N[Si](C)(C)C)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C3950.8Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,5TMS,isomer #3CN(C(=O)CC(N[Si](C)(C)C)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C4725.4Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,5TMS,isomer #4CNC(=O)CC(C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C4059.4Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,5TMS,isomer #4CNC(=O)CC(C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C3994.3Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,5TMS,isomer #4CNC(=O)CC(C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C4829.2Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,5TMS,isomer #5CNC(=O)CC(C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C1)N([Si](C)(C)C)[Si](C)(C)C4084.2Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,5TMS,isomer #5CNC(=O)CC(C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C1)N([Si](C)(C)C)[Si](C)(C)C4006.1Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,5TMS,isomer #5CNC(=O)CC(C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C1)N([Si](C)(C)C)[Si](C)(C)C4745.4Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,5TMS,isomer #6CNC(=O)CC(N[Si](C)(C)C)C(=O)N(C(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C3928.6Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,5TMS,isomer #6CNC(=O)CC(N[Si](C)(C)C)C(=O)N(C(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C3931.2Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,5TMS,isomer #6CNC(=O)CC(N[Si](C)(C)C)C(=O)N(C(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C4639.5Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,5TMS,isomer #7CN(C(=O)CC(N)C(=O)N(C(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)[Si](C)(C)C3934.0Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,5TMS,isomer #7CN(C(=O)CC(N)C(=O)N(C(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)[Si](C)(C)C3945.3Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,5TMS,isomer #7CN(C(=O)CC(N)C(=O)N(C(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)[Si](C)(C)C)C1=CC=C(O[Si](C)(C)C)C=C1)[Si](C)(C)C)[Si](C)(C)C5106.0Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,5TMS,isomer #8CN(C(=O)CC(C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4023.5Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,5TMS,isomer #8CN(C(=O)CC(C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4096.7Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,5TMS,isomer #8CN(C(=O)CC(C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4953.7Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,5TMS,isomer #9CN(C(=O)CC(C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)[Si](C)(C)C)C1=CC=C(O)C=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4055.6Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,5TMS,isomer #9CN(C(=O)CC(C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)[Si](C)(C)C)C1=CC=C(O)C=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4099.0Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,5TMS,isomer #9CN(C(=O)CC(C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C)[Si](C)(C)C)C1=CC=C(O)C=C1)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C4832.2Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,1TBDMS,isomer #1CNC(=O)CC(N)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C(C)(C)C)C1=CC=C(O)C=C14303.9Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,1TBDMS,isomer #1CNC(=O)CC(N)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C(C)(C)C)C1=CC=C(O)C=C14044.5Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,1TBDMS,isomer #1CNC(=O)CC(N)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C(C)(C)C)C1=CC=C(O)C=C16642.9Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,1TBDMS,isomer #2CNC(=O)CC(N)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O[Si](C)(C)C(C)(C)C)C=C14430.4Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,1TBDMS,isomer #2CNC(=O)CC(N)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O[Si](C)(C)C(C)(C)C)C=C14040.7Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,1TBDMS,isomer #2CNC(=O)CC(N)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O[Si](C)(C)C(C)(C)C)C=C16456.5Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,1TBDMS,isomer #3CNC(=O)CC(N[Si](C)(C)C(C)(C)C)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O)C=C14406.2Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,1TBDMS,isomer #3CNC(=O)CC(N[Si](C)(C)C(C)(C)C)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O)C=C14068.6Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,1TBDMS,isomer #3CNC(=O)CC(N[Si](C)(C)C(C)(C)C)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O)C=C16255.7Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,1TBDMS,isomer #4CN(C(=O)CC(N)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C4473.6Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,1TBDMS,isomer #4CN(C(=O)CC(N)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C4056.9Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,1TBDMS,isomer #4CN(C(=O)CC(N)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C6732.1Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,1TBDMS,isomer #5CNC(=O)CC(N)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C4340.5Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,1TBDMS,isomer #5CNC(=O)CC(N)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C4011.8Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,1TBDMS,isomer #5CNC(=O)CC(N)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C6529.9Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,1TBDMS,isomer #6CNC(=O)CC(N)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C(C)(C)C)C1=CC=C(O)C=C14384.7Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,1TBDMS,isomer #6CNC(=O)CC(N)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C(C)(C)C)C1=CC=C(O)C=C14020.3Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,1TBDMS,isomer #6CNC(=O)CC(N)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C(C)(C)C)C1=CC=C(O)C=C16606.0Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TBDMS,isomer #1CNC(=O)CC(N)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C(C)(C)C)C1=CC=C(O[Si](C)(C)C(C)(C)C)C=C14539.8Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TBDMS,isomer #1CNC(=O)CC(N)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C(C)(C)C)C1=CC=C(O[Si](C)(C)C(C)(C)C)C=C14250.6Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TBDMS,isomer #1CNC(=O)CC(N)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C(C)(C)C)C1=CC=C(O[Si](C)(C)C(C)(C)C)C=C16028.4Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TBDMS,isomer #10CN(C(=O)CC(N[Si](C)(C)C(C)(C)C)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C4644.7Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TBDMS,isomer #10CN(C(=O)CC(N[Si](C)(C)C(C)(C)C)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C4305.6Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TBDMS,isomer #10CN(C(=O)CC(N[Si](C)(C)C(C)(C)C)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C5850.0Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TBDMS,isomer #11CNC(=O)CC(C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O)C=C1)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C4698.0Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TBDMS,isomer #11CNC(=O)CC(C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O)C=C1)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C4335.3Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TBDMS,isomer #11CNC(=O)CC(C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O)C=C1)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C5861.1Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TBDMS,isomer #12CNC(=O)CC(N[Si](C)(C)C(C)(C)C)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C4523.3Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TBDMS,isomer #12CNC(=O)CC(N[Si](C)(C)C(C)(C)C)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C4254.3Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TBDMS,isomer #12CNC(=O)CC(N[Si](C)(C)C(C)(C)C)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C5793.7Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TBDMS,isomer #13CNC(=O)CC(N[Si](C)(C)C(C)(C)C)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C(C)(C)C)C1=CC=C(O)C=C14551.1Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TBDMS,isomer #13CNC(=O)CC(N[Si](C)(C)C(C)(C)C)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C(C)(C)C)C1=CC=C(O)C=C14280.8Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TBDMS,isomer #13CNC(=O)CC(N[Si](C)(C)C(C)(C)C)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C(C)(C)C)C1=CC=C(O)C=C15686.9Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TBDMS,isomer #14CN(C(=O)CC(N)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C4564.3Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TBDMS,isomer #14CN(C(=O)CC(N)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C4256.0Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TBDMS,isomer #14CN(C(=O)CC(N)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C6115.8Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TBDMS,isomer #15CN(C(=O)CC(N)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C(C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C4596.6Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TBDMS,isomer #15CN(C(=O)CC(N)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C(C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C4263.6Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TBDMS,isomer #15CN(C(=O)CC(N)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C(C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C6164.8Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TBDMS,isomer #16CNC(=O)CC(N)C(=O)N(C(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C(C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C4472.2Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TBDMS,isomer #16CNC(=O)CC(N)C(=O)N(C(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C(C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C4236.6Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TBDMS,isomer #16CNC(=O)CC(N)C(=O)N(C(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C(C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C5999.3Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TBDMS,isomer #2CNC(=O)CC(N[Si](C)(C)C(C)(C)C)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C(C)(C)C)C1=CC=C(O)C=C14493.8Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TBDMS,isomer #2CNC(=O)CC(N[Si](C)(C)C(C)(C)C)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C(C)(C)C)C1=CC=C(O)C=C14286.9Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TBDMS,isomer #2CNC(=O)CC(N[Si](C)(C)C(C)(C)C)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C(C)(C)C)C1=CC=C(O)C=C15715.4Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TBDMS,isomer #3CN(C(=O)CC(N)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C(C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C4549.5Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TBDMS,isomer #3CN(C(=O)CC(N)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C(C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C4279.2Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TBDMS,isomer #3CN(C(=O)CC(N)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C(C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C6198.2Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TBDMS,isomer #4CNC(=O)CC(N)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C(C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C4409.7Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TBDMS,isomer #4CNC(=O)CC(N)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C(C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C4228.6Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TBDMS,isomer #4CNC(=O)CC(N)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C(C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C6017.5Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TBDMS,isomer #5CNC(=O)CC(N)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C1=CC=C(O)C=C14458.5Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TBDMS,isomer #5CNC(=O)CC(N)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C1=CC=C(O)C=C14240.3Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TBDMS,isomer #5CNC(=O)CC(N)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C1=CC=C(O)C=C16039.9Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TBDMS,isomer #6CNC(=O)CC(N[Si](C)(C)C(C)(C)C)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O[Si](C)(C)C(C)(C)C)C=C14643.8Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TBDMS,isomer #6CNC(=O)CC(N[Si](C)(C)C(C)(C)C)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O[Si](C)(C)C(C)(C)C)C=C14274.3Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TBDMS,isomer #6CNC(=O)CC(N[Si](C)(C)C(C)(C)C)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O[Si](C)(C)C(C)(C)C)C=C15700.0Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TBDMS,isomer #7CN(C(=O)CC(N)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O[Si](C)(C)C(C)(C)C)C=C1)[Si](C)(C)C(C)(C)C4672.3Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TBDMS,isomer #7CN(C(=O)CC(N)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O[Si](C)(C)C(C)(C)C)C=C1)[Si](C)(C)C(C)(C)C4279.8Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TBDMS,isomer #7CN(C(=O)CC(N)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O[Si](C)(C)C(C)(C)C)C=C1)[Si](C)(C)C(C)(C)C6108.3Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TBDMS,isomer #8CNC(=O)CC(N)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O[Si](C)(C)C(C)(C)C)C=C1)[Si](C)(C)C(C)(C)C4551.2Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TBDMS,isomer #8CNC(=O)CC(N)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O[Si](C)(C)C(C)(C)C)C=C1)[Si](C)(C)C(C)(C)C4222.8Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TBDMS,isomer #8CNC(=O)CC(N)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O[Si](C)(C)C(C)(C)C)C=C1)[Si](C)(C)C(C)(C)C5909.5Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TBDMS,isomer #9CNC(=O)CC(N)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C(C)(C)C)C1=CC=C(O[Si](C)(C)C(C)(C)C)C=C14598.1Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TBDMS,isomer #9CNC(=O)CC(N)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C(C)(C)C)C1=CC=C(O[Si](C)(C)C(C)(C)C)C=C14234.4Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,2TBDMS,isomer #9CNC(=O)CC(N)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C(C)(C)C)C1=CC=C(O[Si](C)(C)C(C)(C)C)C=C15996.3Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TBDMS,isomer #1CNC(=O)CC(N[Si](C)(C)C(C)(C)C)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C(C)(C)C)C1=CC=C(O[Si](C)(C)C(C)(C)C)C=C14715.0Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TBDMS,isomer #1CNC(=O)CC(N[Si](C)(C)C(C)(C)C)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C(C)(C)C)C1=CC=C(O[Si](C)(C)C(C)(C)C)C=C14433.5Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TBDMS,isomer #1CNC(=O)CC(N[Si](C)(C)C(C)(C)C)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C(C)(C)C)C1=CC=C(O[Si](C)(C)C(C)(C)C)C=C15361.2Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TBDMS,isomer #10CN(C(=O)CC(N)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C4643.7Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TBDMS,isomer #10CN(C(=O)CC(N)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C4464.2Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TBDMS,isomer #10CN(C(=O)CC(N)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C5755.0Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TBDMS,isomer #11CNC(=O)CC(N)C(=O)N(C(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C4516.1Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TBDMS,isomer #11CNC(=O)CC(N)C(=O)N(C(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C4425.5Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TBDMS,isomer #11CNC(=O)CC(N)C(=O)N(C(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C5612.0Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TBDMS,isomer #12CN(C(=O)CC(N[Si](C)(C)C(C)(C)C)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O[Si](C)(C)C(C)(C)C)C=C1)[Si](C)(C)C(C)(C)C4825.1Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TBDMS,isomer #12CN(C(=O)CC(N[Si](C)(C)C(C)(C)C)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O[Si](C)(C)C(C)(C)C)C=C1)[Si](C)(C)C(C)(C)C4480.1Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TBDMS,isomer #12CN(C(=O)CC(N[Si](C)(C)C(C)(C)C)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O[Si](C)(C)C(C)(C)C)C=C1)[Si](C)(C)C(C)(C)C5487.2Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TBDMS,isomer #13CNC(=O)CC(C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O[Si](C)(C)C(C)(C)C)C=C1)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C4898.5Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TBDMS,isomer #13CNC(=O)CC(C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O[Si](C)(C)C(C)(C)C)C=C1)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C4507.2Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TBDMS,isomer #13CNC(=O)CC(C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O[Si](C)(C)C(C)(C)C)C=C1)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C5473.5Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TBDMS,isomer #14CNC(=O)CC(N[Si](C)(C)C(C)(C)C)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O[Si](C)(C)C(C)(C)C)C=C1)[Si](C)(C)C(C)(C)C4723.4Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TBDMS,isomer #14CNC(=O)CC(N[Si](C)(C)C(C)(C)C)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O[Si](C)(C)C(C)(C)C)C=C1)[Si](C)(C)C(C)(C)C4424.5Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TBDMS,isomer #14CNC(=O)CC(N[Si](C)(C)C(C)(C)C)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O[Si](C)(C)C(C)(C)C)C=C1)[Si](C)(C)C(C)(C)C5406.5Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TBDMS,isomer #15CNC(=O)CC(N[Si](C)(C)C(C)(C)C)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C(C)(C)C)C1=CC=C(O[Si](C)(C)C(C)(C)C)C=C14742.8Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TBDMS,isomer #15CNC(=O)CC(N[Si](C)(C)C(C)(C)C)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C(C)(C)C)C1=CC=C(O[Si](C)(C)C(C)(C)C)C=C14445.8Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TBDMS,isomer #15CNC(=O)CC(N[Si](C)(C)C(C)(C)C)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C(C)(C)C)C1=CC=C(O[Si](C)(C)C(C)(C)C)C=C15356.3Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TBDMS,isomer #16CN(C(=O)CC(N)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O[Si](C)(C)C(C)(C)C)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C4741.3Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TBDMS,isomer #16CN(C(=O)CC(N)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O[Si](C)(C)C(C)(C)C)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C4437.4Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TBDMS,isomer #16CN(C(=O)CC(N)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O[Si](C)(C)C(C)(C)C)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C5703.6Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TBDMS,isomer #17CN(C(=O)CC(N)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C(C)(C)C)C1=CC=C(O[Si](C)(C)C(C)(C)C)C=C1)[Si](C)(C)C(C)(C)C4766.0Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TBDMS,isomer #17CN(C(=O)CC(N)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C(C)(C)C)C1=CC=C(O[Si](C)(C)C(C)(C)C)C=C1)[Si](C)(C)C(C)(C)C4462.0Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TBDMS,isomer #17CN(C(=O)CC(N)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C(C)(C)C)C1=CC=C(O[Si](C)(C)C(C)(C)C)C=C1)[Si](C)(C)C(C)(C)C5763.5Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TBDMS,isomer #18CNC(=O)CC(N)C(=O)N(C(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C(C)(C)C)C1=CC=C(O[Si](C)(C)C(C)(C)C)C=C1)[Si](C)(C)C(C)(C)C4648.4Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TBDMS,isomer #18CNC(=O)CC(N)C(=O)N(C(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C(C)(C)C)C1=CC=C(O[Si](C)(C)C(C)(C)C)C=C1)[Si](C)(C)C(C)(C)C4412.5Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TBDMS,isomer #18CNC(=O)CC(N)C(=O)N(C(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C(C)(C)C)C1=CC=C(O[Si](C)(C)C(C)(C)C)C=C1)[Si](C)(C)C(C)(C)C5608.3Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TBDMS,isomer #19CN(C(=O)CC(C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O)C=C1)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C4936.2Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TBDMS,isomer #19CN(C(=O)CC(C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O)C=C1)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C4557.8Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TBDMS,isomer #19CN(C(=O)CC(C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O)C=C1)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C5585.0Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TBDMS,isomer #2CN(C(=O)CC(N)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C(C)(C)C)C1=CC=C(O[Si](C)(C)C(C)(C)C)C=C1)[Si](C)(C)C(C)(C)C4739.9Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TBDMS,isomer #2CN(C(=O)CC(N)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C(C)(C)C)C1=CC=C(O[Si](C)(C)C(C)(C)C)C=C1)[Si](C)(C)C(C)(C)C4459.2Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TBDMS,isomer #2CN(C(=O)CC(N)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C(C)(C)C)C1=CC=C(O[Si](C)(C)C(C)(C)C)C=C1)[Si](C)(C)C(C)(C)C5771.8Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TBDMS,isomer #20CN(C(=O)CC(N[Si](C)(C)C(C)(C)C)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C4707.3Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TBDMS,isomer #20CN(C(=O)CC(N[Si](C)(C)C(C)(C)C)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C4489.5Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TBDMS,isomer #20CN(C(=O)CC(N[Si](C)(C)C(C)(C)C)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C5533.2Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TBDMS,isomer #21CN(C(=O)CC(N[Si](C)(C)C(C)(C)C)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C(C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C4722.4Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TBDMS,isomer #21CN(C(=O)CC(N[Si](C)(C)C(C)(C)C)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C(C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C4497.0Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TBDMS,isomer #21CN(C(=O)CC(N[Si](C)(C)C(C)(C)C)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C(C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C5451.6Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TBDMS,isomer #22CNC(=O)CC(C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C4811.8Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TBDMS,isomer #22CNC(=O)CC(C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C4513.0Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TBDMS,isomer #22CNC(=O)CC(C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C5534.5Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TBDMS,isomer #23CNC(=O)CC(C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C(C)(C)C)C1=CC=C(O)C=C1)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C4832.6Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TBDMS,isomer #23CNC(=O)CC(C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C(C)(C)C)C1=CC=C(O)C=C1)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C4534.9Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TBDMS,isomer #23CNC(=O)CC(C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C(C)(C)C)C1=CC=C(O)C=C1)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C5444.1Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TBDMS,isomer #24CNC(=O)CC(N[Si](C)(C)C(C)(C)C)C(=O)N(C(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C(C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C4614.1Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TBDMS,isomer #24CNC(=O)CC(N[Si](C)(C)C(C)(C)C)C(=O)N(C(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C(C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C4482.7Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TBDMS,isomer #24CNC(=O)CC(N[Si](C)(C)C(C)(C)C)C(=O)N(C(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C(C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C5394.8Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TBDMS,isomer #25CN(C(=O)CC(N)C(=O)N(C(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C(C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C4655.6Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TBDMS,isomer #25CN(C(=O)CC(N)C(=O)N(C(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C(C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C4468.6Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TBDMS,isomer #25CN(C(=O)CC(N)C(=O)N(C(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O)[Si](C)(C)C(C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C5746.2Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TBDMS,isomer #3CNC(=O)CC(N)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C(C)(C)C)C1=CC=C(O[Si](C)(C)C(C)(C)C)C=C1)[Si](C)(C)C(C)(C)C4621.0Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TBDMS,isomer #3CNC(=O)CC(N)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C(C)(C)C)C1=CC=C(O[Si](C)(C)C(C)(C)C)C=C1)[Si](C)(C)C(C)(C)C4379.7Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TBDMS,isomer #3CNC(=O)CC(N)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C(C)(C)C)C1=CC=C(O[Si](C)(C)C(C)(C)C)C=C1)[Si](C)(C)C(C)(C)C5605.9Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TBDMS,isomer #4CNC(=O)CC(N)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C1=CC=C(O[Si](C)(C)C(C)(C)C)C=C14677.8Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TBDMS,isomer #4CNC(=O)CC(N)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C1=CC=C(O[Si](C)(C)C(C)(C)C)C=C14405.6Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TBDMS,isomer #4CNC(=O)CC(N)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C1=CC=C(O[Si](C)(C)C(C)(C)C)C=C15640.3Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TBDMS,isomer #5CN(C(=O)CC(N[Si](C)(C)C(C)(C)C)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C(C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C4690.1Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TBDMS,isomer #5CN(C(=O)CC(N[Si](C)(C)C(C)(C)C)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C(C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C4494.1Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TBDMS,isomer #5CN(C(=O)CC(N[Si](C)(C)C(C)(C)C)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C(C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C5452.9Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TBDMS,isomer #6CNC(=O)CC(C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C(C)(C)C)C1=CC=C(O)C=C1)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C4758.5Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TBDMS,isomer #6CNC(=O)CC(C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C(C)(C)C)C1=CC=C(O)C=C1)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C4524.1Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TBDMS,isomer #6CNC(=O)CC(C(=O)NC(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C(C)(C)C)C1=CC=C(O)C=C1)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C5444.9Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TBDMS,isomer #7CNC(=O)CC(N[Si](C)(C)C(C)(C)C)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C(C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C4571.3Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TBDMS,isomer #7CNC(=O)CC(N[Si](C)(C)C(C)(C)C)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C(C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C4451.2Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TBDMS,isomer #7CNC(=O)CC(N[Si](C)(C)C(C)(C)C)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C(C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C5391.5Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TBDMS,isomer #8CNC(=O)CC(N[Si](C)(C)C(C)(C)C)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C1=CC=C(O)C=C14604.3Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TBDMS,isomer #8CNC(=O)CC(N[Si](C)(C)C(C)(C)C)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C1=CC=C(O)C=C14463.7Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TBDMS,isomer #8CNC(=O)CC(N[Si](C)(C)C(C)(C)C)C(=O)NC(C(=O)N(C1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C1=CC=C(O)C=C15269.1Standard polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TBDMS,isomer #9CN(C(=O)CC(N)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C(C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C4603.2Semi standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TBDMS,isomer #9CN(C(=O)CC(N)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C(C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C4449.4Standard non polar33892256
6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3TBDMS,isomer #9CN(C(=O)CC(N)C(=O)N(C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O[Si](C)(C)C(C)(C)C)C1=CC=C(O)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C5751.2Standard polar33892256
Spectra

GC-MS Spectra

Spectrum TypeDescriptionSplash KeyDeposition DateSourceView
Predicted GC-MSPredicted GC-MS Spectrum - 6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid GC-MS (Non-derivatized) - 70eV, Positivesplash10-0zfu-8941300000-edcc89ff90eae5c649182021-09-23Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - 6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid GC-MS (Non-derivatized) - 70eV, PositiveNot Available2021-10-12Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - 6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid GC-MS (Non-derivatized) - 70eV, PositiveNot Available2021-10-12Wishart LabView Spectrum

MS/MS Spectra

Spectrum TypeDescriptionSplash KeyDeposition DateSourceView
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid 10V, Positive-QTOFsplash10-01ox-0222900000-497f85deee9863da76132021-10-12Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid 20V, Positive-QTOFsplash10-02n9-0292200000-5c1b2f552306384f86d12021-10-12Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid 40V, Positive-QTOFsplash10-0229-7948000000-7d9ccd74af7787ed11dd2021-10-12Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid 10V, Negative-QTOFsplash10-0002-1013900000-0bfbcfec8265c6b5e5c12021-10-12Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid 20V, Negative-QTOFsplash10-0a4i-9535300000-6ceab7f51634df7527e92021-10-12Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 6-[[2-[[2-Amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid 40V, Negative-QTOFsplash10-006x-9600000000-e9220db216f7180bfbeb2021-10-12Wishart LabView Spectrum

NMR Spectra

Spectrum TypeDescriptionDeposition DateSourceView
Predicted 1D NMR13C NMR Spectrum (1D, 100 MHz, D2O, predicted)2021-10-13Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 100 MHz, D2O, predicted)2021-10-13Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 1000 MHz, D2O, predicted)2021-10-13Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 1000 MHz, D2O, predicted)2021-10-13Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 200 MHz, D2O, predicted)2021-10-13Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 200 MHz, D2O, predicted)2021-10-13Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 300 MHz, D2O, predicted)2021-10-13Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 300 MHz, D2O, predicted)2021-10-13Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 400 MHz, D2O, predicted)2021-10-13Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 400 MHz, D2O, predicted)2021-10-13Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 500 MHz, D2O, predicted)2021-10-13Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 500 MHz, D2O, predicted)2021-10-13Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 600 MHz, D2O, predicted)2021-10-13Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 600 MHz, D2O, predicted)2021-10-13Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 700 MHz, D2O, predicted)2021-10-13Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 700 MHz, D2O, predicted)2021-10-13Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 800 MHz, D2O, predicted)2021-10-13Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 800 MHz, D2O, predicted)2021-10-13Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 900 MHz, D2O, predicted)2021-10-13Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 900 MHz, D2O, predicted)2021-10-13Wishart 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 ID2158
KEGG Compound IDNot Available
BioCyc IDNot Available
BiGG IDNot Available
Wikipedia LinkNot Available
METLIN IDNot Available
PubChem Compound2245
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 ]