Molecule FYI-1016690

A

Molecule Summary:

ID: FYI-1016690
Names:
InChIKey: NMFVKENSIPBUGU-UHFFFAOYSA-N
SMILES: O=C1CCCCC(=O)OCCOC(=O)CCCCC(=O)OCCOCCCO1

Received at FYIcenter.com on: 2026-02-17

Molecule ID: FYI-1016690 Edit

Molecule Structure InChIKey: NMFVKENSIPBUGU-UHFFFAOYSA-N

Molecule Structure SMILES String: O=C1CCCCC(=O)OCCOC(=O)CCCCC(=O)OCCOCCCO1

Download SDF Download SVG Structure in 2D SDF:

FYI-1016690
FYIcenter.com

 28 28  0  0  0  0  0  0  0  0999 V2000
    3.6373    2.1000    0.0000 O   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
    2.4249    0.0000    0.0000 O   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
    6.0622    0.7000    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
    7.2747    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2747    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    4.9000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871    4.9000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    7.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    8.4000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871    9.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2747    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    9.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8498    8.4000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    9.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373   10.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2125    9.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    7.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2125    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    7.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2125    4.9000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  2  0  0  0  0
  4  2  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
  9  8  2  0  0  0  0
 10  8  1  0  0  0  0
 11 10  1  0  0  0  0
 12 11  1  0  0  0  0
 13 12  1  0  0  0  0
 14 13  1  0  0  0  0
 15 14  1  0  0  0  0
 16 15  1  0  0  0  0
 17 16  1  0  0  0  0
 18 17  1  0  0  0  0
 19 18  2  0  0  0  0
 20 18  1  0  0  0  0
 21 20  1  0  0  0  0
 22 21  1  0  0  0  0
 23 22  1  0  0  0  0
 24 23  1  0  0  0  0
 25 24  2  0  0  0  0
 26 24  1  0  0  0  0
 27 26  1  0  0  0  0
 28 27  1  0  0  0  0
 28  1  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1016690-3D
FYIcenter.com

 58 58  0  0  0  0  0  0  0  0999 V2000
    3.3035   -6.3376    6.1113 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.5373   -6.3088    6.1924 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3490   -7.4196    7.4487 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7845   -9.0356    8.0779 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7071   -9.9075    9.3401 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1868  -10.7593    9.6731 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7139  -10.5197    9.2837 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6696  -10.8218    9.9959 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.9249  -10.1493    7.9817 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.6715   -9.8984    7.4345 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5610   -9.0193    6.2843 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4937   -9.4002    5.4224 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7688   -8.4291    4.8132 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6822   -8.6885    4.3003 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2783   -7.0032    4.8956 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7558   -6.7834    5.0900 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2405   -5.5102    4.5600 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7655   -5.4486    4.7003 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6491   -4.4539    3.9149 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8693   -4.5724    4.0307 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.1459   -3.4618    3.1166 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.7526   -3.4693    3.0322 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7364   -2.5721    2.3840 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5338   -3.1906    2.9660 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.2913   -2.6781    2.5819 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0266   -3.4696    3.1141 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5340   -4.3608    4.4467 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2596   -5.3290    5.4087 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.4234   -7.9352    7.2295 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1891   -6.8063    8.3592 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6323   -9.7547    7.2579 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8492   -9.1306    8.6715 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.3717   -9.5429   10.3141 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.1348  -10.8534    9.2199 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.0338  -11.8101    9.3611 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.2498  -10.7959   10.7691 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.2657   -9.2112    8.1746 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.1251  -10.8177    7.2621 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.5116   -9.0092    5.7706 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.2610   -8.0993    6.7928 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.8657   -6.5574    5.7881 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9101   -6.4883    4.0019 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.3059   -7.5659    4.5716 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.0150   -6.6792    6.1514 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.7355   -4.7076    5.1147 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.8861   -5.5827    3.5398 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.1513   -6.4509    4.4367 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.9927   -5.3323    5.7733 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.4545   -3.3559    4.0716 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.5483   -4.3960    2.4984 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.7588   -2.6731    1.2931 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.8601   -1.5280    2.6818 H   0  0  0  0  0  0  0  0  0  0  0  0
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    6.2411   -1.6110    2.8406 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2718   -2.6580    3.0890 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7141   -4.0640    2.2408 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7127   -4.9584    4.0199 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0657   -3.6175    5.1053 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 28  1  0  0  0  0
  3  4  1  0  0  0  0
  3 29  1  0  0  0  0
  3 30  1  0  0  0  0
  4  5  1  0  0  0  0
  4 31  1  0  0  0  0
  4 32  1  0  0  0  0
  5  6  1  0  0  0  0
  5 33  1  0  0  0  0
  5 34  1  0  0  0  0
  6  7  1  0  0  0  0
  6 35  1  0  0  0  0
  6 36  1  0  0  0  0
  7  8  2  0  0  0  0
  7  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
 10 37  1  0  0  0  0
 10 38  1  0  0  0  0
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 12 13  1  0  0  0  0
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 17 18  1  0  0  0  0
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 17 46  1  0  0  0  0
 18 19  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 49  1  0  0  0  0
 22 50  1  0  0  0  0
 23 24  1  0  0  0  0
 23 51  1  0  0  0  0
 23 52  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
 25 53  1  0  0  0  0
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 26 27  1  0  0  0  0
 26 55  1  0  0  0  0
 26 56  1  0  0  0  0
 27 28  1  0  0  0  0
 27 57  1  0  0  0  0
 27 58  1  0  0  0  0
M  END
$$$$

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2026-03-22, 680👍, 0💬