Molecule FYI-1016045

A

Molecule Summary:

ID: FYI-1016045
Names:
InChIKey: YCSKKMNTFVZDAR-UHFFFAOYSA-N
SMILES: CC(O)C(=O)OC(C)C(=O)OC(C)C(=O)OC(C)C(=O)OC(C)C(=O)OC(C)C(=O)O

Received at FYIcenter.com on: 2025-11-12

Molecule ID: FYI-1016045 Edit

Molecule Structure InChIKey: YCSKKMNTFVZDAR-UHFFFAOYSA-N

Molecule Structure SMILES String: CC(O)C(=O)OC(C)C(=O)OC(C)C(=O)OC(C)C(=O)OC(C)C(=O)OC(C)C(=O)O

Download SDF Download SVG Structure in 2D SDF:

FYI-1016045
FYIcenter.com

 31 30  0  0  0  0  0  0  0  0999 V2000
    0.0000    1.9628    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1738    2.7258    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2863    4.1212    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3765    2.0091    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1865    0.6220    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6284    2.6357    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.6361    1.6639    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3534    0.2927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8832    2.3001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9169    3.6997    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.9153    1.3541    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.1344    2.0425    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3179    3.4304    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4028    1.4498    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3200    0.0522    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.6180    2.1448    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.8474    1.4750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0398    0.0883    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1295    2.0374    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1631    3.4370    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.3323    1.3209    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.4931    2.1035    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.8359    3.4609    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.6979    1.3904    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.8156    2.2335    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.8617    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.9421    1.4023    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.0640    0.0076    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.1290    2.1447    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.0792    3.5438    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   21.3322    1.4288    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  2  4  1  0  0  0  0
  4  5  2  0  0  0  0
  4  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  7  9  1  0  0  0  0
  9 10  2  0  0  0  0
  9 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 12 14  1  0  0  0  0
 14 15  2  0  0  0  0
 14 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
 17 19  1  0  0  0  0
 19 20  2  0  0  0  0
 19 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 22 24  1  0  0  0  0
 24 25  1  0  0  0  0
 24 26  2  0  0  0  0
 25 27  1  0  0  0  0
 27 28  1  0  0  0  0
 27 29  1  0  0  0  0
 29 30  2  0  0  0  0
 29 31  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1016045-3D
FYIcenter.com

 57 56  0  0  1  0  0  0  0  0999 V2000
    9.9596    3.1448    5.8554 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2481    3.3052    5.0651 C   0  0  3  0  0  0  0  0  0  0  0  0
   12.3411    3.1794    5.9719 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.3125    2.2987    3.9093 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1722    1.4352    3.7927 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.2813    2.4989    3.0442 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.2545    1.6537    1.8810 C   0  0  3  0  0  0  0  0  0  0  0  0
    9.6597    0.2985    2.2574 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4090    2.3082    0.7815 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8272    1.6920   -0.1053 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.4120    3.6680    0.8930 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.6472    4.3828   -0.0924 C   0  0  3  0  0  0  0  0  0  0  0  0
    7.1758    4.3718    0.3247 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1408    5.8314   -0.2295 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4315    6.7707   -0.5735 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.4753    5.9453    0.0351 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.0284    7.2776   -0.0510 C   0  0  3  0  0  0  0  0  0  0  0  0
   10.7041    8.0336    1.2337 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5527    7.2054   -0.2337 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2073    6.1727   -0.2989 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.0925    8.4576   -0.3425 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.5280    8.5308   -0.4801 C   0  0  3  0  0  0  0  0  0  0  0  0
   14.9091    8.2944   -1.9378 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.0251    9.9188   -0.0448 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3121   10.8218    0.3717 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.3894   10.0121   -0.1722 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.9592   11.2998    0.1668 C   0  0  3  0  0  0  0  0  0  0  0  0
   17.1500   11.4127    1.6729 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.3234   11.4510   -0.5138 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.0351   12.4408   -0.4232 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.6897   10.3641   -1.2349 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.9401    3.8375    6.7033 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.8803    2.1324    6.2670 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.0781    3.3283    5.2338 H   0  0  0  0  0  0  0  0  0  0  0  0
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   12.4273    2.2321    6.1877 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.2644    1.5402    1.4686 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.6485    0.4161    2.6631 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.2542   -0.1955    3.0325 H   0  0  0  0  0  0  0  0  0  0  0  0
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    7.0466    4.8417    1.3064 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.7937    3.3493    0.4137 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.5476    4.9064   -0.3951 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.6267    7.7867   -0.9360 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.1290    7.5162    2.1014 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.6240    8.0942    1.3995 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.1033    9.0523    1.2153 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.0002    7.8013    0.1890 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.4523    9.0532   -2.5834 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.5553    7.3212   -2.2899 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.9933    8.3357   -2.0829 H   0  0  0  0  0  0  0  0  0  0  0  0
   16.3258   12.1021   -0.2302 H   0  0  0  0  0  0  0  0  0  0  0  0
   17.7897   10.6049    2.0460 H   0  0  0  0  0  0  0  0  0  0  0  0
   16.1956   11.3343    2.2013 H   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
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  1 33  1  0  0  0  0
  1 34  1  0  0  0  0
  2  3  1  0  0  0  0
  2  4  1  0  0  0  0
  2 35  1  0  0  0  0
  3 36  1  0  0  0  0
  4  5  2  0  0  0  0
  4  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  7  9  1  0  0  0  0
  7 37  1  0  0  0  0
  8 38  1  0  0  0  0
  8 39  1  0  0  0  0
  8 40  1  0  0  0  0
  9 10  2  0  0  0  0
  9 11  1  0  0  0  0
 11 12  1  0  0  0  0
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 17 19  1  0  0  0  0
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 18 46  1  0  0  0  0
 18 47  1  0  0  0  0
 18 48  1  0  0  0  0
 19 20  2  0  0  0  0
 19 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 22 24  1  0  0  0  0
 22 49  1  0  0  0  0
 23 50  1  0  0  0  0
 23 51  1  0  0  0  0
 23 52  1  0  0  0  0
 24 25  2  0  0  0  0
 24 26  1  0  0  0  0
 26 27  1  0  0  0  0
 27 28  1  0  0  0  0
 27 29  1  0  0  0  0
 27 53  1  0  0  0  0
 28 54  1  0  0  0  0
 28 55  1  0  0  0  0
 28 56  1  0  0  0  0
 29 30  2  0  0  0  0
 29 31  1  0  0  0  0
 31 57  1  0  0  0  0
M  END
$$$$

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