Molecule Editor

Molecule ID: FYI-1004988 Edit

Molecule Structure InChIKey: UZMPYXSDDZXMAI-UHFFFAOYSA-N

Molecule Structure SMILES String: CCCCCCCCCCCCCCCC(=O)OCC(COP(=O)(O)OC1C(O)C(OP(=O)(O)O)C(O)C(OP(=O)(O)O)C1O)OC(=O)CCCCCCCCCCCCCCC

Download SDF Download SVG Structure in 2D SDF:

FYI-1004988
FYIcenter.com

 63 63  0  0  0  0  0  0  0  0999 V2000
   12.1244    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5493    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5493    5.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7617    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7617    7.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9741    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9741    9.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.1866   10.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.1866   11.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.3990   12.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.3990   14.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.6115   14.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.6115   16.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.3990   16.8000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   21.8239   16.8000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   21.8239   18.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.6115   18.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.6115   20.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.8239   21.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   21.8239   22.4000    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
   21.1239   23.6124    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   20.4239   22.4000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   23.0363   23.1000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   24.2487   22.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.4611   23.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   26.6736   22.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   26.6736   21.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.4611   20.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.2487   21.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.0363   20.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   25.4611   18.9000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   24.2487   18.2000    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
   24.9487   16.9876    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   23.0363   17.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   23.5487   19.4124    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   27.8860   20.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   27.8860   23.1000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   27.8860   24.5000    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
   29.2860   24.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   27.8860   25.9000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   26.4860   24.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   25.4611   24.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.3990   18.2000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.1866   18.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.1866   20.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.9741   18.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7617   18.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5493   18.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368   18.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244   18.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9120   18.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995   18.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871   18.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746   18.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622   18.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8498   18.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373   18.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249   18.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124   18.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   18.2000    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  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  2  0  0  0  0
 18 16  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  2  0  0  0  0
 25 23  1  0  0  0  0
 26 23  1  0  0  0  0
 27 26  1  0  0  0  0
 28 27  1  0  0  0  0
 29 28  1  0  0  0  0
 30 29  1  0  0  0  0
 31 30  1  0  0  0  0
 32 31  1  0  0  0  0
 32 27  1  0  0  0  0
 33 32  1  0  0  0  0
 34 31  1  0  0  0  0
 35 34  1  0  0  0  0
 36 35  2  0  0  0  0
 37 35  1  0  0  0  0
 38 35  1  0  0  0  0
 39 30  1  0  0  0  0
 40 29  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 41  1  0  0  0  0
 45 28  1  0  0  0  0
 46 20  1  0  0  0  0
 47 46  1  0  0  0  0
 48 47  2  0  0  0  0
 49 47  1  0  0  0  0
 50 49  1  0  0  0  0
 51 50  1  0  0  0  0
 52 51  1  0  0  0  0
 53 52  1  0  0  0  0
 54 53  1  0  0  0  0
 55 54  1  0  0  0  0
 56 55  1  0  0  0  0
 57 56  1  0  0  0  0
 58 57  1  0  0  0  0
 59 58  1  0  0  0  0
 60 59  1  0  0  0  0
 61 60  1  0  0  0  0
 62 61  1  0  0  0  0
 63 62  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1004988-3D
FYIcenter.com

144144  0  0  1  0  0  0  0  0999 V2000
   29.7752   20.3937   -2.2941 C   0  0  0  0  0  0  0  0  0  0  0  0
   29.2758   19.8033   -0.9876 C   0  0  0  0  0  0  0  0  0  0  0  0
   28.4628   18.5403   -1.2468 C   0  0  0  0  0  0  0  0  0  0  0  0
   27.9546   17.9458    0.0606 C   0  0  0  0  0  0  0  0  0  0  0  0
   27.1489   16.6796   -0.2001 C   0  0  0  0  0  0  0  0  0  0  0  0
   26.6386   16.0934    1.1092 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.8317   14.8294    0.8480 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.3261   14.2424    2.1580 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.5156   12.9804    1.8970 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.0137   12.3895    3.2073 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.1994   11.1268    2.9492 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.6939   10.5353    4.2599 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.8783    9.2654    4.0177 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.3716    8.6972    5.3398 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.5653    7.4156    5.1574 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.0939    6.8994    6.5015 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.3738    5.7558    6.9192 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.3425    7.7980    7.1544 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.8908    7.3911    8.4536 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.4225    8.3253    9.5403 C   0  0  3  0  0  0  0  0  0  0  0  0
   18.9068    7.8495   10.9025 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.3519    8.6878   11.9873 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.7654    8.1507   13.5237 P   0  0  3  0  0  0  0  0  0  0  0  0
   20.0392    7.3608   13.7370 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.5851    9.7035   13.9270 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.1788    7.6136   15.0601 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.7719    7.1972   14.8353 C   0  0  3  0  0  0  0  0  0  0  0  0
   16.1574    6.7227   16.1737 C   0  0  3  0  0  0  0  0  0  0  0  0
   14.7260    6.8383   16.1761 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.5553    5.2591   16.4565 C   0  0  3  0  0  0  0  0  0  0  0  0
   15.9827    4.7346   17.6201 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.4244    5.6635   19.0111 P   0  0  0  0  0  0  0  0  0  0  0  0
   15.1119    5.2715   19.7116 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.6119    4.6073   19.2851 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.8660    6.5924   20.4022 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.0422    4.3160   15.3820 C   0  0  3  0  0  0  0  0  0  0  0  0
   14.6348    4.4720   15.1893 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.8663    4.6978   14.1912 C   0  0  3  0  0  0  0  0  0  0  0  0
   16.9069    3.7189   13.1679 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.5582    3.3147   12.4283 P   0  0  0  0  0  0  0  0  0  0  0  0
   14.4594    4.3489   12.4544 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.0149    2.9103   10.9853 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.0587    1.9763   13.1384 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.4694    6.0926   13.7241 C   0  0  3  0  0  0  0  0  0  0  0  0
   17.0090    6.1504   12.4146 O   0  0  0  0  0  0  0  0  0  0  0  0
   20.8620    8.3055    9.5373 O   0  0  0  0  0  0  0  0  0  0  0  0
   21.4532    9.5210    9.3732 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.8727   10.5889    9.1415 O   0  0  0  0  0  0  0  0  0  0  0  0
   22.9537    9.4302    9.4479 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.4977   10.3423   10.5477 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.9526    9.9773   11.9278 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.5125   10.9178   12.9925 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.9699   10.5586   14.3698 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.5292   11.4949   15.4334 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.9811   11.1269   16.8044 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.5401   12.0624   17.8650 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.9896   11.6900   19.2319 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.5473   12.6217   20.2954 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.9959   12.2484   21.6625 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.5527   13.1798   22.7294 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.9988   12.8071   24.0986 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.5498   13.7308   25.1778 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.9966   13.3579   26.5421 C   0  0  0  0  0  0  0  0  0  0  0  0
   30.3574   21.2994   -2.1051 H   0  0  0  0  0  0  0  0  0  0  0  0
   28.9363   20.6540   -2.9478 H   0  0  0  0  0  0  0  0  0  0  0  0
   30.4132   19.6790   -2.8240 H   0  0  0  0  0  0  0  0  0  0  0  0
   28.6602   20.5432   -0.4633 H   0  0  0  0  0  0  0  0  0  0  0  0
   30.1302   19.5728   -0.3407 H   0  0  0  0  0  0  0  0  0  0  0  0
   29.0815   17.8043   -1.7743 H   0  0  0  0  0  0  0  0  0  0  0  0
   27.6132   18.7743   -1.9005 H   0  0  0  0  0  0  0  0  0  0  0  0
   27.3285   18.6789    0.5821 H   0  0  0  0  0  0  0  0  0  0  0  0
   28.8011   17.7156    0.7193 H   0  0  0  0  0  0  0  0  0  0  0  0
   27.7742   15.9431   -0.7177 H   0  0  0  0  0  0  0  0  0  0  0  0
   26.3015   16.9065   -0.8593 H   0  0  0  0  0  0  0  0  0  0  0  0
   26.0152   16.8300    1.6297 H   0  0  0  0  0  0  0  0  0  0  0  0
   27.4851   15.8622    1.7683 H   0  0  0  0  0  0  0  0  0  0  0  0
   26.4542   14.0924    0.3267 H   0  0  0  0  0  0  0  0  0  0  0  0
   24.9830   15.0598    0.1918 H   0  0  0  0  0  0  0  0  0  0  0  0
   24.7062   14.9807    2.6815 H   0  0  0  0  0  0  0  0  0  0  0  0
   26.1755   14.0100    2.8123 H   0  0  0  0  0  0  0  0  0  0  0  0
   25.1353   12.2447    1.3703 H   0  0  0  0  0  0  0  0  0  0  0  0
   23.6658   13.2149    1.2445 H   0  0  0  0  0  0  0  0  0  0  0  0
   23.3980   13.1288    3.7341 H   0  0  0  0  0  0  0  0  0  0  0  0
   24.8659   12.1563    3.8576 H   0  0  0  0  0  0  0  0  0  0  0  0
   23.8187   10.3901    2.4232 H   0  0  0  0  0  0  0  0  0  0  0  0
   22.3504   11.3630    2.2961 H   0  0  0  0  0  0  0  0  0  0  0  0
   22.0768   11.2767    4.7821 H   0  0  0  0  0  0  0  0  0  0  0  0
   23.5458   10.3076    4.9131 H   0  0  0  0  0  0  0  0  0  0  0  0
   22.4962    8.5210    3.5016 H   0  0  0  0  0  0  0  0  0  0  0  0
   21.0296    9.4954    3.3614 H   0  0  0  0  0  0  0  0  0  0  0  0
   20.7459    9.4463    5.8379 H   0  0  0  0  0  0  0  0  0  0  0  0
   22.2221    8.4990    6.0036 H   0  0  0  0  0  0  0  0  0  0  0  0
   21.1868    6.6500    4.6752 H   0  0  0  0  0  0  0  0  0  0  0  0
   19.6963    7.5955    4.5148 H   0  0  0  0  0  0  0  0  0  0  0  0
   19.1879    6.3581    8.6743 H   0  0  0  0  0  0  0  0  0  0  0  0
   17.7936    7.4145    8.4484 H   0  0  0  0  0  0  0  0  0  0  0  0
   19.0411    9.3358    9.3444 H   0  0  0  0  0  0  0  0  0  0  0  0
   19.2214    6.8258   11.1323 H   0  0  0  0  0  0  0  0  0  0  0  0
   17.8135    7.8898   10.8542 H   0  0  0  0  0  0  0  0  0  0  0  0
   17.7805   10.0770   13.5089 H   0  0  0  0  0  0  0  0  0  0  0  0
   16.2432    8.1129   14.5438 H   0  0  0  0  0  0  0  0  0  0  0  0
   16.4905    7.3701   16.9826 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.2698    6.2975   15.5395 H   0  0  0  0  0  0  0  0  0  0  0  0
   17.6480    5.1844   16.5797 H   0  0  0  0  0  0  0  0  0  0  0  0
   17.3764    3.7000   19.0377 H   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$