Molecule FYI-1001664

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A

Molecule Summary:

ID: FYI-1001664
SMILES: O=C1CCc2c1scc2

Received at FYIcenter.com on: 2022-10-27

Molecule ID: FYI-1001664 Edit

Molecule Structure SMILES String: O=C1CCc2c1scc2

Download SDF Download SVG Structure in 2D SDF:

FYI-1001664
FYIcenter.com

  9 10  0  0  0  0  0  0  0  0999 V2000
    3.4282    4.3452    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2158    3.6452    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9369    4.2146    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    3.1742    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7000    1.9618    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0695    2.2529    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7695    1.0405    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.8326    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5537    0.5694    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  2  0  0  0  0
  6  2  1  0  0  0  0
  7  6  1  0  0  0  0
  8  7  1  0  0  0  0
  9  8  2  0  0  0  0
  9  5  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1001664-3D
FYIcenter.com

 15 16  0  0  0  0  0  0  0  0999 V2000
    1.1016   -0.0231    0.0805 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3234    0.0009    0.0798 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2329   -1.2400    0.0684 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6956   -0.6892    0.0896 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5217    0.7827    0.0888 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2012    1.1297    0.0854 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9125    2.7716    0.0843 S   0  0  0  0  0  0  0  0  0  0  0  0
    4.6175    3.0785    0.0873 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3671    1.9112    0.0905 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0499   -1.8203   -0.8414 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0346   -1.8551    0.9514 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2485   -1.0288   -0.7918 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2217   -1.0284    0.9877 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9762    4.0988    0.0867 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4501    1.8933    0.0930 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  2  6  1  0  0  0  0
  3  4  1  0  0  0  0
  3 10  1  0  0  0  0
  3 11  1  0  0  0  0
  4  5  1  0  0  0  0
  4 12  1  0  0  0  0
  4 13  1  0  0  0  0
  5  6  2  0  0  0  0
  5  9  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  2  0  0  0  0
  8 14  1  0  0  0  0
  9 15  1  0  0  0  0
M  END
$$$$

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2022-11-19, 1795👍, 0💬