Molecule FYI-1014805

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A

Molecule Summary:

ID: FYI-1014805
Names:
InChIKey: RALDEEUHNXQFIN-UHFFFAOYSA-N
SMILES: C=C(CCCCCCCCCCCCCCCCCC)C(N)=O

Received at FYIcenter.com on: 2025-05-27

Molecule ID: FYI-1014805 Edit

Molecule Structure InChIKey: RALDEEUHNXQFIN-UHFFFAOYSA-N

Molecule Structure SMILES String: C=C(CCCCCCCCCCCCCCCCCC)C(N)=O

Download SDF Download SVG Structure in 2D SDF:

FYI-1014805
FYIcenter.com

 23 22  0  0  0  0  0  0  0  0999 V2000
   24.2487    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.0363    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.8239    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.6114    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.3990    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.1866    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9742    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7616    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5492    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2747    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0621    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    3.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    1.4000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
  4  3  1  0  0  0  0
  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
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 18 17  1  0  0  0  0
 19 18  1  0  0  0  0
 20 19  2  0  0  0  0
 21 19  1  0  0  0  0
 22 21  2  0  0  0  0
 23 21  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1014805-3D
FYIcenter.com

 64 63  0  0  0  0  0  0  0  0999 V2000
    1.0280   -0.0700   -0.1385 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3768   -0.0387   -0.1014 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1643    0.8137    0.8855 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2685    1.6336    1.8226 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0341    2.4967    2.8106 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0349    3.2580    3.6763 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7653    4.1304    4.6781 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7744    4.8883    5.5429 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5239    5.7565    6.5372 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5418    6.5170    7.4079 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2962    7.3830    8.3996 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3151    8.1442    9.2712 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0694    9.0102   10.2629 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0881    9.7717   11.1349 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8418   10.6385   12.1275 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8615   11.4015   13.0012 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.1722    6.4616    6.0024 H   0  0  0  0  0  0  0  0  0  0  0  0
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 21 22  1  0  0  0  0
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 22 63  1  0  0  0  0
 22 64  1  0  0  0  0
M  END
$$$$

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2025-06-21, 2779👍, 0💬