Molecule FYI-1000992

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Molecule Summary:

ID: FYI-1000992
SMILES: C1CCCCCNCCCCCC1CSSCCC2CCCCCCCC2

Received at FYIcenter.com on: 2021-09-10

Molecule ID: FYI-1000992 Edit

Molecule Structure SMILES String: C1CCCCCNCCCCCC1CSSCCC2CCCCCCCC2

Download SDF Download SVG Structure in 2D SDF:

FYI-1000992
FYIcenter.com

 27 28  0  0  0  0  0  0  0  0999 V2000
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   11.8386    0.5487    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1266    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5220    0.1127    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7053    0.8609    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.4053    2.0733    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   16.4617    3.4722    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.8615    4.7370    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7423    5.5781    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3604    5.8026    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0324    5.3593    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0626    4.3496    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8502    5.0496    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    6.2129    4.3496    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.2431    4.3496    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.9709    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7000    1.7585    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0155    1.2796    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3312    1.7585    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0312    2.9709    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  5  4  1  0  0  0  0
  6  5  1  0  0  0  0
  7  6  1  0  0  0  0
  8  7  1  0  0  0  0
  9  8  1  0  0  0  0
 10  9  1  0  0  0  0
 11 10  1  0  0  0  0
 12 11  1  0  0  0  0
 13 12  1  0  0  0  0
 13  1  1  0  0  0  0
 14 13  1  0  0  0  0
 15 14  1  0  0  0  0
 16 15  1  0  0  0  0
 17 16  1  0  0  0  0
 18 17  1  0  0  0  0
 19 18  1  0  0  0  0
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 21 20  1  0  0  0  0
 22 21  1  0  0  0  0
 23 22  1  0  0  0  0
 24 23  1  0  0  0  0
 25 24  1  0  0  0  0
 26 25  1  0  0  0  0
 27 26  1  0  0  0  0
 27 19  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1000992-3D
FYIcenter.com

 74 75  0  0  1  0  0  0  0  0999 V2000
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 21 22  1  0  0  0  0
 21 61  1  0  0  0  0
 21 62  1  0  0  0  0
 22 23  1  0  0  0  0
 22 63  1  0  0  0  0
 22 64  1  0  0  0  0
 23 24  1  0  0  0  0
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 24 25  1  0  0  0  0
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 25 26  1  0  0  0  0
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 26 71  1  0  0  0  0
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 27 73  1  0  0  0  0
 27 74  1  0  0  0  0
M  END
$$$$

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2022-04-02, 1592👍, 0💬