Molecule FYI-1015815

A

Molecule Summary:

ID: FYI-1015815
Names:
InChIKey: WZAUMJWYUXITCB-XKQJLSEDSA-N
SMILES: COCC(=O)N2CC[C@H](n1nnc(C(N)=O)c1C(N)=O)C[C@H]2C(=O)N[C@H](Cc3c[nH]c4ccccc34)C(N)=O

Received at FYIcenter.com on: 2025-10-15

Molecule ID: FYI-1015815 Edit

Molecule Structure InChIKey: WZAUMJWYUXITCB-XKQJLSEDSA-N

Molecule Structure SMILES String: COCC(=O)N2CC[C@H](n1nnc(C(N)=O)c1C(N)=O)C[C@H]2C(=O)N[C@H](Cc3c[nH]c4ccccc34)C(N)=O

Download SDF Download SVG Structure in 2D SDF:

FYI-1015815
FYIcenter.com

 39 42  0  0  1  0  0  0  0  0999 V2000
   11.9258    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7134    0.7000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.7134    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5009    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2885    2.1000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.5009    4.2000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.7134    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7134    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5009    7.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2885    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2885    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0761    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   11.0238   11.6870    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4162   11.5406    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.4544   12.9659    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.9650    8.7903    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2561    7.4208    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.0055    9.7270    0.0000 N   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  2  0  0  0  0
  6  4  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
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 11 10  1  0  0  0  0
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 11 12  1  6  0  0  0
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 27 26  2  0  0  0  0
 28 26  1  0  0  0  0
  9 29  1  1  0  0  0
 30 29  1  0  0  0  0
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 36 34  1  0  0  0  0
 37 30  1  0  0  0  0
 38 37  2  0  0  0  0
 39 37  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1015815-3D
FYIcenter.com

 68 71  0     1  0  0  0  0  0999 V2000
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M  END
$$$$

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2025-10-24, 1104👍, 0💬