Molecule Editor

Molecule ID: FYI-1004144 Edit

Molecule Structure InChIKey: GOIKIOHGMNUNBL-UHFFFAOYSA-J

Molecule Structure SMILES String: O=C([O-])C4OC(OC3C(O)C(O)C(OC2C(O)C(O)C(OC1C(O)C(O)C(O)OC1C(=O)[O-])OC2C(=O)[O-])OC3C(=O)[O-])C(O)C(O)C4O

Download SDF Download SVG Structure in 2D SDF:

FYI-1004144
FYIcenter.com

 49 52  0  0  0  0  0  0  0  0999 V2000
    7.2746   18.2000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746   16.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622   16.1000    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    8.4870   16.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4870   14.7000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995   14.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995   12.6000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4870   11.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746   12.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746   14.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622   11.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497   12.6000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622   10.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    9.8000    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
    6.0622    7.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    8.4000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    5.6000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    5.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    4.2000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    3.5000    0.0000 C   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    5.6000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    4.2000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    1.4000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    1.4000    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
    4.8497    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    2.1000    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    3.6373    6.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    7.7000    0.0000 C   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
    1.2124    7.7000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    9.8000    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    7.2746    9.8000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4870   10.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    9.8000    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
   10.9119   10.5000    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
   10.9119   14.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244   14.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119   16.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244   16.8000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995   16.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995   18.2000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  2  1  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  1  0  0  0  0
 10  9  1  0  0  0  0
 11  9  1  0  0  0  0
 12 11  1  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 16  1  0  0  0  0
 19 18  1  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 23  1  0  0  0  0
 26 25  1  0  0  0  0
 27 25  1  0  0  0  0
 28 27  1  0  0  0  0
 29 27  1  0  0  0  0
 30 29  1  0  0  0  0
 30 22  1  0  0  0  0
 31 30  1  0  0  0  0
 32 31  2  0  0  0  0
 33 31  1  0  0  0  0
 34 20  1  0  0  0  0
 35 34  1  0  0  0  0
 35 15  1  0  0  0  0
 36 35  1  0  0  0  0
 37 36  2  0  0  0  0
 38 36  1  0  0  0  0
 39 13  1  0  0  0  0
 40 39  1  0  0  0  0
 40  8  1  0  0  0  0
 41 40  1  0  0  0  0
 42 41  2  0  0  0  0
 43 41  1  0  0  0  0
 44  6  1  0  0  0  0
 45 44  1  0  0  0  0
 46 44  1  0  0  0  0
 47 46  1  0  0  0  0
 48 46  1  0  0  0  0
 48  4  1  0  0  0  0
 49 48  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1004144-3D
FYIcenter.com

 79 82  0  0  1  0  0  0  0  0999 V2000
   -2.7945    3.4153   -3.7173 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2973    2.4297   -4.3191 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3582    2.3950   -5.0241 O   0  5  0  0  0  0  0  0  0  0  0  0
   -2.4784    1.1125   -4.3839 C   0  0  3  0  0  0  0  0  0  0  0  0
   -1.5316    0.9125   -3.3041 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4148    1.8056   -3.2773 C   0  0  3  0  0  0  0  0  0  0  0  0
    0.5368    1.4236   -2.2462 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0027    1.3015   -0.8939 C   0  0  3  0  0  0  0  0  0  0  0  0
   -0.4085    2.6588   -0.3073 C   0  0  3  0  0  0  0  0  0  0  0  0
   -1.1458    2.5165    0.9209 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8200    3.5811   -0.1057 C   0  0  3  0  0  0  0  0  0  0  0  0
    0.3853    4.7913    0.5433 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1156    2.9302    0.5449 C   0  0  3  0  0  0  0  0  0  0  0  0
    2.3143    3.1772    1.9874 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6926    2.8871    2.4635 C   0  0  3  0  0  0  0  0  0  0  0  0
    3.7767    1.3910    2.7799 C   0  0  3  0  0  0  0  0  0  0  0  0
    5.1066    0.9753    3.1415 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7687    1.1056    3.9050 C   0  0  3  0  0  0  0  0  0  0  0  0
    2.6242   -0.3095    4.0460 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1108    1.8213    5.2467 C   0  0  3  0  0  0  0  0  0  0  0  0
    4.0186    1.0221    6.0906 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7810    1.1218    7.5317 C   0  0  3  0  0  0  0  0  0  0  0  0
    4.8585    2.0734    8.1060 C   0  0  3  0  0  0  0  0  0  0  0  0
    4.6258    2.4101    9.5050 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.2478    1.4030    8.0252 C   0  0  3  0  0  0  0  0  0  0  0  0
    7.2581    2.2911    8.5443 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.2485    0.0753    8.8170 C   0  0  3  0  0  0  0  0  0  0  0  0
    6.1661    0.2784   10.2376 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.2339   -0.7966    8.3414 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.9127   -0.1969    8.3690 C   0  0  3  0  0  0  0  0  0  0  0  0
    2.7671   -1.2486    8.2960 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0824   -2.4587    8.3227 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6067   -0.7362    8.4230 O   0  5  0  0  0  0  0  0  0  0  0  0
    3.4768    3.2035    5.0432 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.1903    3.5604    3.8041 C   0  0  3  0  0  0  0  0  0  0  0  0
    4.5014    5.0891    3.6838 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9685    5.4703    2.5636 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.3801    5.7945    4.7326 O   0  5  0  0  0  0  0  0  0  0  0  0
    2.2647    1.5571    0.1426 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0438    0.7700    0.1172 C   0  0  3  0  0  0  0  0  0  0  0  0
    1.2540   -0.7369   -0.1779 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3016   -1.0769   -0.8005 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3402   -1.4976    0.2744 O   0  5  0  0  0  0  0  0  0  0  0  0
    0.3092    1.7768   -4.6622 C   0  0  3  0  0  0  0  0  0  0  0  0
    0.8577    0.4582   -4.9470 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6615    2.0890   -5.8217 C   0  0  3  0  0  0  0  0  0  0  0  0
    0.0446    1.9632   -7.0793 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8259    1.0791   -5.7722 C   0  0  3  0  0  0  0  0  0  0  0  0
   -2.7515    1.2407   -6.8642 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1997    0.2894   -4.3127 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7182    2.8299   -3.0667 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8566    0.6171   -0.9212 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1133    3.1540   -0.9812 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6106    2.9231    1.6281 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1236    3.8722   -1.1231 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4939    4.9921    0.1945 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9468    3.4610    0.0657 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3987    3.1618    1.6689 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5263    0.7911    1.9068 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9889    0.3313    3.8683 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7892    1.4895    3.5926 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3433   -0.6384    3.1687 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1641    1.8712    5.7951 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7811    1.5287    7.7248 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8739    3.0208    7.5599 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6569    2.3857    9.6322 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4883    1.1855    6.9790 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.8014    2.8038    9.2348 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.2085   -0.4285    8.6673 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6109    1.0735   10.3467 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7697    0.0927    9.4289 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2135    3.1895    3.9816 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6378    0.7956    1.1388 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1638    2.4623   -4.6726 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6570   -0.0761   -4.1475 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0246    3.1207   -5.7794 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4138    1.0592   -7.0464 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4084    0.0775   -5.9318 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5546    1.6797   -6.4905 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  4  1  0  0  0  0
  4  5  1  0  0  0  0
  4 48  1  0  0  0  0
  4 50  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  6 44  1  0  0  0  0
  6 51  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  8 40  1  0  0  0  0
  8 52  1  0  0  0  0
  9 10  1  0  0  0  0
  9 11  1  0  0  0  0
  9 53  1  0  0  0  0
 10 54  1  0  0  0  0
 11 12  1  0  0  0  0
 11 13  1  0  0  0  0
 11 55  1  0  0  0  0
 12 56  1  0  0  0  0
 13 14  1  0  0  0  0
 13 39  1  0  0  0  0
 13 57  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
 15 35  1  0  0  0  0
 15 58  1  0  0  0  0
 16 17  1  0  0  0  0
 16 18  1  0  0  0  0
 16 59  1  0  0  0  0
 17 60  1  0  0  0  0
 18 19  1  0  0  0  0
 18 20  1  0  0  0  0
 18 61  1  0  0  0  0
 19 62  1  0  0  0  0
 20 21  1  0  0  0  0
 20 34  1  0  0  0  0
 20 63  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 22 30  1  0  0  0  0
 22 64  1  0  0  0  0
 23 24  1  0  0  0  0
 23 25  1  0  0  0  0
 23 65  1  0  0  0  0
 24 66  1  0  0  0  0
 25 26  1  0  0  0  0
 25 27  1  0  0  0  0
 25 67  1  0  0  0  0
 26 68  1  0  0  0  0
 27 28  1  0  0  0  0
 27 29  1  0  0  0  0
 27 69  1  0  0  0  0
 28 70  1  0  0  0  0
 29 30  1  0  0  0  0
 30 31  1  0  0  0  0
 30 71  1  0  0  0  0
 31 32  2  0  0  0  0
 31 33  1  0  0  0  0
 34 35  1  0  0  0  0
 35 36  1  0  0  0  0
 35 72  1  0  0  0  0
 36 37  2  0  0  0  0
 36 38  1  0  0  0  0
 39 40  1  0  0  0  0
 40 41  1  0  0  0  0
 40 73  1  0  0  0  0
 41 42  2  0  0  0  0
 41 43  1  0  0  0  0
 44 45  1  0  0  0  0
 44 46  1  0  0  0  0
 44 74  1  0  0  0  0
 45 75  1  0  0  0  0
 46 47  1  0  0  0  0
 46 48  1  0  0  0  0
 46 76  1  0  0  0  0
 47 77  1  0  0  0  0
 48 49  1  0  0  0  0
 48 78  1  0  0  0  0
 49 79  1  0  0  0  0
M  END
$$$$