Molecule FYI-1003781

Home > Molecule

A

Molecule Summary:

ID: FYI-1003781
Names:
InChIKey: HMOAOHSKDQBURF-UHFFFAOYSA-N
SMILES: C1OCOCOCOCOCOCOCOCOCOCOCO1

Received at FYIcenter.com on: 2023-07-26

Molecule ID: FYI-1003781 Edit

Molecule Structure InChIKey: HMOAOHSKDQBURF-UHFFFAOYSA-N

Molecule Structure SMILES String: C1OCOCOCOCOCOCOCOCOCOCOCO1

Download SDF Download SVG Structure in 2D SDF:

FYI-1003781
FYIcenter.com

 24 24  0  0  0  0  0  0  0  0999 V2000
    2.4249    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    9.1000    0.0000 O   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 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    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 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    0.7000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0621    0.7000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0621    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2747    2.8000    0.0000 O   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
    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 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871    9.1000    0.0000 O   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
    6.0621    9.1000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    9.1000    0.0000 O   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
  9  8  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
 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  1  0  0  0  0
 20 19  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
 24  1  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1003781-3D
FYIcenter.com

 48 48  0  0  0  0  0  0  0  0999 V2000
    8.8485    1.0989   -7.8767 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4722    0.8976   -8.2636 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.2375    1.1304   -9.8470 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0062    1.3889   -9.9479 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.8150    1.7404  -11.3148 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2739    1.2355  -11.5150 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.5677    2.0616  -11.6321 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.3031    2.3746  -10.3939 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.2850    2.2161   -9.4834 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.2728    2.3906   -8.1037 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.9069    1.9928   -7.9304 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4260    2.0843   -6.6586 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.0681    1.8035   -6.7145 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6686    1.9128   -5.4048 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.3279    1.5271   -5.4232 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9649    1.5395   -4.1006 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.6290    1.3482   -4.1175 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9391    1.7107   -2.9201 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.6654    1.2919   -3.3316 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4385    1.7001   -2.8199 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5549    1.3613   -3.9428 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0447    0.2322   -4.7818 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.6681    0.3146   -6.1824 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2132    0.4562   -6.5060 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.8642    2.1373   -7.5593 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.1770    0.9700   -8.7322 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.5615    0.1080   -9.7671 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.1631    2.1967   -9.7810 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.2854    1.2395  -12.1286 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.8308    2.8269  -11.4592 H   0  0  0  0  0  0  0  0  0  0  0  0
   17.3095    1.4414  -12.1589 H   0  0  0  0  0  0  0  0  0  0  0  0
   16.4597    2.9975  -12.1956 H   0  0  0  0  0  0  0  0  0  0  0  0
   16.0553    1.1498   -9.5941 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.5441    2.9335   -9.8586 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.7624    0.9536   -8.2703 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.2846    2.7201   -8.5135 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.9091    0.7842   -7.2045 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.5317    2.5393   -7.4277 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.1456    0.5172   -5.9239 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.7563    2.2898   -6.0481 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.4350    0.2983   -4.3929 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.2337    2.0113   -4.9025 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.6785    0.1949   -3.3092 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.5819    1.7303   -4.3297 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3923    2.2688   -4.5295 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6163    1.0951   -3.4328 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.5134   -0.7457   -6.4306 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.0102    0.9057   -6.8180 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 24  1  0  0  0  0
  1 25  1  0  0  0  0
  1 26  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  3 27  1  0  0  0  0
  3 28  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  5 29  1  0  0  0  0
  5 30  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  7 31  1  0  0  0  0
  7 32  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
  9 33  1  0  0  0  0
  9 34  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 11 35  1  0  0  0  0
 11 36  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 13 37  1  0  0  0  0
 13 38  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
 15 39  1  0  0  0  0
 15 40  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
 17 41  1  0  0  0  0
 17 42  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 19 43  1  0  0  0  0
 19 44  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 21 45  1  0  0  0  0
 21 46  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 23 47  1  0  0  0  0
 23 48  1  0  0  0  0
M  END
$$$$

✍: FYIcenter.com

2023-08-09, 2306👍, 0💬