Molecule FYI-1016631

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Molecule Summary:

ID: FYI-1016631
Names:
InChIKey: PICGPEBVZGCYBV-CWWKMNTPSA-N
SMILES: CC/C=C\\C\\C=C/CCO

Received at FYIcenter.com on: 2026-02-03

Molecule ID: FYI-1016631 Edit

Molecule Structure InChIKey: PICGPEBVZGCYBV-CWWKMNTPSA-N

Molecule Structure SMILES String: CC/C=C\C\C=C/CCO

Download SDF Download SVG Structure in 2D SDF:

FYI-1016631
FYIcenter.com

 10  9  0  0  0  0  0  0  0  0999 V2000
    7.2746    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8498    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6372    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4248    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    0.7000    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
    0.0000    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    4.2000    0.0000 O   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  2  0  0  0  0
  5  4  1  0  0  0  0
  6  5  1  0  0  0  0
  7  6  2  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
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1016631-3D
FYIcenter.com

 26 25  0     0  0  0  0  0  0999 V2000
    4.0166    0.9318    0.5339 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4449   -0.0734   -0.1011 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4751   -0.3712   -0.7798 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5281   -0.8605    0.7274 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8284   -0.9935    0.4256 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5775   -0.9312   -0.5853 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3255    0.3767    0.6484 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8611   -0.7302   -0.2510 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0182    1.0197   -0.4745 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6573    1.6320   -0.1435 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0079    0.3872   -0.9829 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7744    0.7738    0.5063 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8084   -0.3441   -1.6465 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3054   -1.0276   -1.0717 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1543   -1.3294    1.6345 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4649   -1.5652    1.0960 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2317    0.0330    1.1630 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6125    0.5994    1.4478 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3369   -1.7500   -1.2590 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6194   -1.3887   -0.6663 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4702    1.4615   -1.3681 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2306    1.6933   -0.1223 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7716    2.0331   -0.6473 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4205    1.4320   -0.9034 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0440    2.4076    0.5253 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7268    0.3604    0.1952 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  9  1  0  0  0  0
  1 26  1  0  0  0  0
  2  4  1  0  0  0  0
  2  6  1  0  0  0  0
  2 11  1  0  0  0  0
  2 12  1  0  0  0  0
  3  5  1  0  0  0  0
  3  9  1  0  0  0  0
  3 13  1  0  0  0  0
  3 14  1  0  0  0  0
  4  5  2  0  0  0  0
  4 15  1  0  0  0  0
  5 16  1  0  0  0  0
  6  8  2  0  0  0  0
  6 19  1  0  0  0  0
  7  8  1  0  0  0  0
  7 10  1  0  0  0  0
  7 17  1  0  0  0  0
  7 18  1  0  0  0  0
  8 20  1  0  0  0  0
  9 21  1  0  0  0  0
  9 22  1  0  0  0  0
 10 23  1  0  0  0  0
 10 24  1  0  0  0  0
 10 25  1  0  0  0  0
M  END
$$$$

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2026-04-13, 591👍, 0💬