Molecule Editor

Molecule ID: FYI-1014963 Edit

Molecule Structure InChIKey: JHDDJLORUKDDTA-VGWMRTNUSA-N

Molecule Structure SMILES String: C[C@H](NC(=O)CN)C(=O)N1CCC[C@H]1C(=O)NCC(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCNC(=N)N)C(=O)O

Download SDF Download SVG Structure in 2D SDF:

FYI-1014963
FYIcenter.com

 39 40  0  0  1  0  0  0  0  0999 V2000
    0.0000    2.9439    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.3923    3.0903    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9618    4.3692    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1389    5.5018    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3541    4.5156    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.9235    5.7945    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4409    7.3687    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1006    6.9272    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   11.7326    3.5318    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9097    4.6644    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.1249    3.6782    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   13.6943    4.9571    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.8331    6.8214    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   15.0867    5.1035    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.6561    6.3824    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   19.0102    7.9540    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.5796    9.2330    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
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  7 25  1  0  0  0  0
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 21 20  1  0  0  0  0
 22 21  2  0  0  0  0
 23 21  1  0  0  0  0
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 37 36  1  0  0  0  0
 38 37  1  0  0  0  0
 39 38  2  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1014963-3D
FYIcenter.com

 78 79  0  0  1  0  0  0  0  0999 V2000
   10.3714   -2.8708   -0.2850 C   0  0  0  0  0  0  0  0  0  0  0  0
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    9.8666    0.5392   -3.3242 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5641    0.2434   -3.9541 N   0  0  0  0  0  0  0  0  0  0  0  0
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    6.9528   -2.8840   -0.6390 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$