Molecule FYI-1016820

A

Molecule Summary:

ID: FYI-1016820
Names:
InChIKey: ZSYYTNYOAYFALB-UHFFFAOYSA-N
SMILES: CCOC(=O)CCCCCCCCC(=O)OCCOC(=O)CCCCCCCCC(=O)OCCO

Received at FYIcenter.com on: 2026-03-18

Molecule ID: FYI-1016820 Edit

Molecule Structure InChIKey: ZSYYTNYOAYFALB-UHFFFAOYSA-N

Molecule Structure SMILES String: CCOC(=O)CCCCCCCCC(=O)OCCOC(=O)CCCCCCCCC(=O)OCCO

Download SDF Download SVG Structure in 2D SDF:

FYI-1016820
FYIcenter.com

 35 34  0  0  0  0  0  0  0  0999 V2000
    1.4612   12.0299    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8070   10.7922    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4446    9.4398    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3923    8.0407    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6525    6.6653    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    5.3820    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    4.6820    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0437    4.2556    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1049    3.3424    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6950    2.3258    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.0940    2.2735    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1986    0.8774    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4695    2.5337    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7528    3.0936    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8792    3.9250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7924    4.9861    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4465    6.2238    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8090    7.5762    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8613    8.9752    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6009   10.3507    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0411   11.6340    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2536   12.3340    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.2097   12.7604    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.1487   13.6737    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9108   14.3279    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5586   14.6903    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.1596   14.7426    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0550   16.1387    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.7839   14.4824    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5008   13.9225    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3744   13.0909    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9367    2.5710    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6403    1.2027    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.6455    1.3992    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6925    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  2  0  0  0  0
  8  6  1  0  0  0  0
  9  8  1  0  0  0  0
 11 10  1  0  0  0  0
 12 11  2  0  0  0  0
 13 11  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  1  0  0  0  0
 20 19  1  0  0  0  0
 21 20  1  0  0  0  0
 22 21  2  0  0  0  0
 23 21  1  0  0  0  0
 24 23  1  0  0  0  0
 25 24  1  0  0  0  0
 26 25  1  0  0  0  0
 27 26  1  0  0  0  0
 28 27  2  0  0  0  0
 29 27  1  0  0  0  0
 30 29  1  0  0  0  0
 31 30  1  0  0  0  0
 31  1  1  0  0  0  0
  9 32  1  0  0  0  0
 32 33  1  0  0  0  0
 10 34  1  0  0  0  0
 34 35  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1016820-3D
FYIcenter.com

 81 80  0  0  0  0  0  0  0  0999 V2000
   25.9068    2.8875    2.7671 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.3993    1.4922    2.4494 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.0641    1.6195    1.9426 O   0  0  0  0  0  0  0  0  0  0  0  0
   23.0891    1.6145    2.8939 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.2351    1.2556    4.0535 O   0  0  0  0  0  0  0  0  0  0  0  0
   21.8303    2.2142    2.3176 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.7660    2.3680    3.3989 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.5158    3.0693    2.8762 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.4708    3.1863    3.9852 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.2035    3.8764    3.4879 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.1626    3.9815    4.6022 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.8965    4.6846    4.1054 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8256    4.7891    5.1847 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2800    5.6602    6.3310 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.6165    6.8306    6.2180 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.2828    4.9508    7.4823 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.7146    5.6712    8.6481 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.2378    5.6432    8.7812 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.6870    6.3967    9.9181 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.4229    5.8461   11.1338 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.8809    4.7638   11.3112 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.9236    6.7276   12.2486 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.3813    8.1502   12.1440 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.8599    9.0138   13.3099 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.3355   10.4451   13.1858 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.8244   11.3141   14.3424 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.3126   12.7515   14.2232 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.8169   13.5932   15.3931 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.3329   15.0413   15.3272 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.7411   15.7918   16.5752 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.3275   15.3009   17.5284 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.3011   17.0789   16.5147 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.2526   17.7630   17.7834 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.6183   18.2296   18.2762 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.1601   19.1802   17.3671 O   0  0  0  0  0  0  0  0  0  0  0  0
   26.9277    2.8618    3.1541 H   0  0  0  0  0  0  0  0  0  0  0  0
   25.2609    3.3784    3.5036 H   0  0  0  0  0  0  0  0  0  0  0  0
   25.8815    3.5115    1.8668 H   0  0  0  0  0  0  0  0  0  0  0  0
   25.4497    0.8377    3.3271 H   0  0  0  0  0  0  0  0  0  0  0  0
   26.0121    1.0354    1.6663 H   0  0  0  0  0  0  0  0  0  0  0  0
   21.4682    1.5776    1.5042 H   0  0  0  0  0  0  0  0  0  0  0  0
   22.0858    3.2021    1.9156 H   0  0  0  0  0  0  0  0  0  0  0  0
   21.1769    2.9407    4.2405 H   0  0  0  0  0  0  0  0  0  0  0  0
   20.5009    1.3787    3.7924 H   0  0  0  0  0  0  0  0  0  0  0  0
   19.1016    2.5078    2.0304 H   0  0  0  0  0  0  0  0  0  0  0  0
   19.7785    4.0683    2.5071 H   0  0  0  0  0  0  0  0  0  0  0  0
   18.8912    3.7510    4.8267 H   0  0  0  0  0  0  0  0  0  0  0  0
   18.2217    2.1864    4.3613 H   0  0  0  0  0  0  0  0  0  0  0  0
   16.7847    3.3155    2.6440 H   0  0  0  0  0  0  0  0  0  0  0  0
   17.4519    4.8796    3.1207 H   0  0  0  0  0  0  0  0  0  0  0  0
   16.5939    4.5329    5.4464 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.9091    2.9791    4.9686 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.4834    4.1279    3.2557 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.1545    5.6856    3.7391 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.5604    3.7914    5.5541 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.9093    5.2307    4.7770 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.2406    5.1879    9.5058 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.3385    6.7018    8.6472 H   0  0  0  0  0  0  0  0  0  0  0  0
   16.6994    6.0959    7.8962 H   0  0  0  0  0  0  0  0  0  0  0  0
   16.6214    4.6162    8.8230 H   0  0  0  0  0  0  0  0  0  0  0  0
   18.0185    6.7133   12.2323 H   0  0  0  0  0  0  0  0  0  0  0  0
   16.6010    6.2801   13.1962 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.2845    8.1265   12.1229 H   0  0  0  0  0  0  0  0  0  0  0  0
   16.7024    8.6067   11.1997 H   0  0  0  0  0  0  0  0  0  0  0  0
   17.9566    9.0244   13.3326 H   0  0  0  0  0  0  0  0  0  0  0  0
   16.5211    8.5764   14.2570 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.2390   10.4351   13.1705 H   0  0  0  0  0  0  0  0  0  0  0  0
   16.6697   10.8782   12.2354 H   0  0  0  0  0  0  0  0  0  0  0  0
   17.9213   11.3166   14.3615 H   0  0  0  0  0  0  0  0  0  0  0  0
   16.4875   10.8818   15.2929 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.2159   12.7524   14.2117 H   0  0  0  0  0  0  0  0  0  0  0  0
   16.6494   13.1899   13.2765 H   0  0  0  0  0  0  0  0  0  0  0  0
   17.9138   13.5790   15.4134 H   0  0  0  0  0  0  0  0  0  0  0  0
   16.4806   13.1363   16.3328 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.2383   15.0613   15.2692 H   0  0  0  0  0  0  0  0  0  0  0  0
   16.7491   15.5426   14.4473 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.7688   17.1157   18.5256 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.5985   18.6284   17.6321 H   0  0  0  0  0  0  0  0  0  0  0  0
   18.3342   17.4103   18.3684 H   0  0  0  0  0  0  0  0  0  0  0  0
   17.5164   18.7118   19.2535 H   0  0  0  0  0  0  0  0  0  0  0  0
   18.1612   18.7381   16.5015 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 36  1  0  0  0  0
  1 37  1  0  0  0  0
  1 38  1  0  0  0  0
  2  3  1  0  0  0  0
  2 39  1  0  0  0  0
  2 40  1  0  0  0  0
  3  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
  6 41  1  0  0  0  0
  6 42  1  0  0  0  0
  7  8  1  0  0  0  0
  7 43  1  0  0  0  0
  7 44  1  0  0  0  0
  8  9  1  0  0  0  0
  8 45  1  0  0  0  0
  8 46  1  0  0  0  0
  9 10  1  0  0  0  0
  9 47  1  0  0  0  0
  9 48  1  0  0  0  0
 10 11  1  0  0  0  0
 10 49  1  0  0  0  0
 10 50  1  0  0  0  0
 11 12  1  0  0  0  0
 11 51  1  0  0  0  0
 11 52  1  0  0  0  0
 12 13  1  0  0  0  0
 12 53  1  0  0  0  0
 12 54  1  0  0  0  0
 13 14  1  0  0  0  0
 13 55  1  0  0  0  0
 13 56  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 57  1  0  0  0  0
 17 58  1  0  0  0  0
 18 19  1  0  0  0  0
 18 59  1  0  0  0  0
 18 60  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  2  0  0  0  0
 20 22  1  0  0  0  0
 22 23  1  0  0  0  0
 22 61  1  0  0  0  0
 22 62  1  0  0  0  0
 23 24  1  0  0  0  0
 23 63  1  0  0  0  0
 23 64  1  0  0  0  0
 24 25  1  0  0  0  0
 24 65  1  0  0  0  0
 24 66  1  0  0  0  0
 25 26  1  0  0  0  0
 25 67  1  0  0  0  0
 25 68  1  0  0  0  0
 26 27  1  0  0  0  0
 26 69  1  0  0  0  0
 26 70  1  0  0  0  0
 27 28  1  0  0  0  0
 27 71  1  0  0  0  0
 27 72  1  0  0  0  0
 28 29  1  0  0  0  0
 28 73  1  0  0  0  0
 28 74  1  0  0  0  0
 29 30  1  0  0  0  0
 29 75  1  0  0  0  0
 29 76  1  0  0  0  0
 30 31  2  0  0  0  0
 30 32  1  0  0  0  0
 32 33  1  0  0  0  0
 33 34  1  0  0  0  0
 33 77  1  0  0  0  0
 33 78  1  0  0  0  0
 34 35  1  0  0  0  0
 34 79  1  0  0  0  0
 34 80  1  0  0  0  0
 35 81  1  0  0  0  0
M  END
$$$$

✍: FYIcenter.com

2026-04-13, 665👍, 0💬