Molecule Editor

Molecule ID: FYI-1015941 Edit

Molecule Structure InChIKey: AMKHVDOOGCZZHC-UHFFFAOYSA-N

Molecule Structure SMILES String: NCCCCCCNC(=O)CCCCCCCCC(=O)NCCCCCO

Download SDF Download SVG Structure in 2D SDF:

FYI-1015941
FYIcenter.com

 27 26  0  0  0  0  0  0  0  0999 V2000
   13.4284    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.6408    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.8532    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.0656    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.2780    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.4904    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.4904    3.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   20.7029    1.4000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   21.9153    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.1278    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.3402    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.5526    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   26.7651    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   27.9775    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   29.1900    2.1000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.2159    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0035    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7910    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5786    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5786    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.3662    2.1000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.1537    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9413    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7289    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5164    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3040    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    1.9094    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  2  0  0  0  0
  8  6  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  1  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  2  0  0  0  0
 21 19  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  1  0  0  0  0
 26 25  1  0  0  0  0
 26 27  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1015941-3D
FYIcenter.com

 70 69  0  0  0  0  0  0  0  0999 V2000
    0.8637    1.1272    5.7153 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.3178    1.1472    5.7965 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8997   -0.0361    5.0291 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4256   -0.0323    5.1039 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0158   -1.2135    4.3376 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5430   -1.2095    4.4122 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1248   -2.3882    3.6379 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5733   -2.4291    3.7005 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.2029   -3.1003    4.7187 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5793   -3.6944    5.6035 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.7156   -3.0759    4.6745 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2868   -3.8750    5.8510 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8101   -3.8860    5.8667 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3267   -4.6935    7.0577 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.8511   -4.7118    7.0846 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3684   -5.5191    8.2753 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.8913   -5.5313    8.2892 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.4625   -6.3264    9.4686 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.9806   -6.2976    9.4279 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.6108   -5.7110    8.5546 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.6091   -6.9896   10.4442 N   0  0  0  0  0  0  0  0  0  0  0  0
   21.0578   -7.0314   10.4935 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.6358   -5.8697   11.2949 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.1620   -5.9338   11.3180 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.7504   -4.7768   12.1183 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.2694   -4.8414   12.1392 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.7833   -3.7537   12.8933 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4890    1.8987    6.2643 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5082    0.2731    6.1439 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6281    1.1069    6.8468 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6898    2.0874    5.3749 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5838    0.0082    3.9791 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5153   -0.9772    5.4424 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7428   -0.0779    6.1531 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8123    0.9064    4.6888 H   0  0  0  0  0  0  0  0  0  0  0  0
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    9.1170   -1.9355    3.0026 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.0539   -2.0370    4.7261 H   0  0  0  0  0  0  0  0  0  0  0  0
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   10.9172   -4.9079    5.8064 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.9174   -3.4518    6.7944 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.1883   -2.8586    5.9259 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.1881   -4.3215    4.9341 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.9476   -5.7215    7.0019 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.9477   -4.2609    7.9921 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.2298   -3.6837    7.1404 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.2296   -5.1442    6.1501 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.9892   -6.5462    8.2170 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.9915   -5.0830    9.2080 H   0  0  0  0  0  0  0  0  0  0  0  0
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   21.3461   -7.9917   10.9365 H   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  1 28  1  0  0  0  0
  1 29  1  0  0  0  0
  2  3  1  0  0  0  0
  2 30  1  0  0  0  0
  2 31  1  0  0  0  0
  3  4  1  0  0  0  0
  3 32  1  0  0  0  0
  3 33  1  0  0  0  0
  4  5  1  0  0  0  0
  4 34  1  0  0  0  0
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  5  6  1  0  0  0  0
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  6  7  1  0  0  0  0
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  7  8  1  0  0  0  0
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 14 50  1  0  0  0  0
 15 16  1  0  0  0  0
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 16 17  1  0  0  0  0
 16 53  1  0  0  0  0
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 17 18  1  0  0  0  0
 17 55  1  0  0  0  0
 17 56  1  0  0  0  0
 18 19  1  0  0  0  0
 18 57  1  0  0  0  0
 18 58  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
 21 59  1  0  0  0  0
 22 23  1  0  0  0  0
 22 60  1  0  0  0  0
 22 61  1  0  0  0  0
 23 24  1  0  0  0  0
 23 62  1  0  0  0  0
 23 63  1  0  0  0  0
 24 25  1  0  0  0  0
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 25 26  1  0  0  0  0
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 27 70  1  0  0  0  0
M  END
$$$$