Molecule FYI-1016703

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Molecule Summary:

ID: FYI-1016703
Names:
InChIKey: HPGHRGIPHODCEW-UHFFFAOYSA-N
SMILES: CCCCCC1OC1CC2OC2CCCCCCCC(=O)OCC

Received at FYIcenter.com on: 2026-02-24

Molecule ID: FYI-1016703 Edit

Molecule Structure InChIKey: HPGHRGIPHODCEW-UHFFFAOYSA-N

Molecule Structure SMILES String: CCCCCC1OC1CC2OC2CCCCCCCC(=O)OCC

Download SDF Download SVG Structure in 2D SDF:

FYI-1016703
FYIcenter.com

 24 25  0  0  0  0  0  0  0  0999 V2000
   18.3741   10.8249    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.3741    9.4249    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.1617    8.7249    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.1617    7.3249    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.9493    6.6249    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.9493    5.2249    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2493    4.0124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.6493    4.0124    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.0368    3.3124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0368    1.9124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7368    0.7000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    0.0000    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
    3.6373    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    2.1000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    0.0000    0.0000 O   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
    0.0000    0.0000    0.0000 C   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
  8  6  1  0  0  0  0
  9  7  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
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 14 13  1  0  0  0  0
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 17 16  1  0  0  0  0
 18 17  1  0  0  0  0
 19 18  1  0  0  0  0
 20 19  1  0  0  0  0
 21 20  2  0  0  0  0
 22 20  1  0  0  0  0
 23 22  1  0  0  0  0
 24 23  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1016703-3D
FYIcenter.com

 60 61  0  0  1  0  0  0  0  0999 V2000
    6.2145   -4.8325  -10.4100 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9628   -4.7863   -8.9087 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5588   -3.3804   -8.4692 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2990   -3.2741   -6.9626 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8752   -1.8455   -6.6116 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6182   -1.6430   -5.1475 C   0  0  3  0  0  0  0  0  0  0  0  0
    4.3034   -0.2673   -4.8624 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.4504   -0.7936   -4.1881 C   0  0  3  0  0  0  0  0  0  0  0  0
    6.7676   -0.1799   -4.5536 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8078    1.3069   -4.3613 C   0  0  3  0  0  0  0  0  0  0  0  0
    8.0779    1.8668   -4.7398 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.6824    2.0812   -3.3805 C   0  0  3  0  0  0  0  0  0  0  0  0
    8.6118    1.4834   -2.3690 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0028    2.1203   -2.4572 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9548    1.5948   -1.3827 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3415    2.2191   -1.5430 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3265    1.7175   -0.4865 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.6901    2.3781   -0.6803 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7097    1.9168    0.3581 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.0637    2.5111    0.0785 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.3276    3.2702   -0.8483 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.9745    1.9923    0.9484 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.3376    2.0869    0.5142 C   0  0  0  0  0  0  0  0  0  0  0  0
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    5.1721   -5.5013   -8.6533 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6557   -3.0791   -9.0149 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.3506   -2.6742   -8.7491 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.2007   -3.5499   -6.4031 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5115   -3.9787   -6.6674 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9482   -1.6137   -7.1508 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6260   -1.1417   -6.9838 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9561   -2.3915   -4.7296 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3481   -0.9502   -3.1214 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.0172   -0.3882   -5.5981 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.5442   -0.6768   -3.9637 H   0  0  0  0  0  0  0  0  0  0  0  0
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    8.6990    0.3990   -2.4869 H   0  0  0  0  0  0  0  0  0  0  0  0
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   10.5566    1.8290   -0.3878 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.2595    3.3113   -1.4754 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.7324    1.9893   -2.5414 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.4277    0.6275   -0.5610 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.9445    1.9430    0.5159 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.5865    3.4704   -0.6274 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.0633    2.1488   -1.6865 H   0  0  0  0  0  0  0  0  0  0  0  0
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   15.3908    2.2066    1.3667 H   0  0  0  0  0  0  0  0  0  0  0  0
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   20.6594    0.8749   -0.7097 H   0  0  0  0  0  0  0  0  0  0  0  0
   18.9522    0.8312   -1.2079 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
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  2  3  1  0  0  0  0
  2 28  1  0  0  0  0
  2 29  1  0  0  0  0
  3  4  1  0  0  0  0
  3 30  1  0  0  0  0
  3 31  1  0  0  0  0
  4  5  1  0  0  0  0
  4 32  1  0  0  0  0
  4 33  1  0  0  0  0
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  6 36  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
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  9 10  1  0  0  0  0
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 24 60  1  0  0  0  0
M  END
$$$$

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2026-03-22, 136👍, 0💬