Molecule FYI-1016186

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Molecule Summary:

ID: FYI-1016186
Names:
InChIKey: HPHUVLMMVZITSG-UHFFFAOYSA-N
SMILES: CCC(C(N)=O)N1CCCC1=O

Received at FYIcenter.com on: 2025-11-29

Molecule ID: FYI-1016186 Edit

Molecule Structure InChIKey: HPHUVLMMVZITSG-UHFFFAOYSA-N

Molecule Structure SMILES String: CCC(C(N)=O)N1CCCC1=O

Download SDF Download SVG Structure in 2D SDF:

FYI-1016186
FYIcenter.com

 12 12  0  0  0  0  0  0  0  0999 V2000
    4.8890    1.7640    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5576    1.3314    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4250    2.1543    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.2922    1.3314    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7250    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1250    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4250    3.5543    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6374    4.2543    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8498    3.5543    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6374    5.6544    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    4.2543    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    3.5543    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  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
  6  2  1  0  0  0  0
  7  3  1  0  0  0  0
  8  7  1  0  0  0  0
  9  8  2  0  0  0  0
 10  8  1  0  0  0  0
 11  7  1  0  0  0  0
 12 11  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1016186-3D
FYIcenter.com

 26 26  0     1  0  0  0  0  0999 V2000
   -1.6080    0.0129   -1.9613 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8869   -0.7536    0.5572 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4043    0.0188    0.0618 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.3881   -2.0416   -0.6127 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6702   -0.3064    1.4430 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9318    0.3256   -0.4010 C   0  0  1  0  0  0  0  0  0  0  0  0
   -2.1787   -0.1961    1.5381 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6618   -0.5715    0.1423 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5260   -0.1295   -0.7505 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4522    1.6489    0.1687 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8419   -0.8530   -0.0815 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5481    2.8456   -0.1041 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9016    0.4157   -1.4949 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1716    0.3866    2.1251 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3353   -1.3296    1.6408 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4614    0.8421    1.7533 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6038   -0.8294    2.3218 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5898   -0.0575   -0.1193 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7883   -1.6538    0.0401 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4413    1.8548   -0.2602 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6074    1.5683    1.2516 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3684    2.9618   -1.1775 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4176    2.7413    0.3996 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0184    3.7635    0.2629 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5273   -2.1033   -1.1466 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9063   -2.9039   -0.4807 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  9  2  0  0  0  0
  2 11  2  0  0  0  0
  3  5  1  0  0  0  0
  3  6  1  0  0  0  0
  3  9  1  0  0  0  0
  4 11  1  0  0  0  0
  4 25  1  0  0  0  0
  4 26  1  0  0  0  0
  5  7  1  0  0  0  0
  5 14  1  0  0  0  0
  5 15  1  0  0  0  0
  6 10  1  0  0  0  0
  6 11  1  0  0  0  0
  6 13  1  0  0  0  0
  7  8  1  0  0  0  0
  7 16  1  0  0  0  0
  7 17  1  0  0  0  0
  8  9  1  0  0  0  0
  8 18  1  0  0  0  0
  8 19  1  0  0  0  0
 10 12  1  0  0  0  0
 10 20  1  0  0  0  0
 10 21  1  0  0  0  0
 12 22  1  0  0  0  0
 12 23  1  0  0  0  0
 12 24  1  0  0  0  0
M  END
$$$$

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2025-12-09, 1267👍, 0💬