Molecule FYI-1014280

A

Molecule Summary:

ID: FYI-1014280
Names:
InChIKey: YWBHCYRCVYEOPE-WXFUMESZSA-N
SMILES: CCCC[C@@H](N[C@H](CCc1ccccc1)C(=O)O)C(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)O

Received at FYIcenter.com on: 2025-03-21

Molecule ID: FYI-1014280 Edit

Molecule Structure InChIKey: YWBHCYRCVYEOPE-WXFUMESZSA-N

Molecule Structure SMILES String: CCCC[C@@H](N[C@H](CCc1ccccc1)C(=O)O)C(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)O

Download SDF Download SVG Structure in 2D SDF:

FYI-1014280
FYIcenter.com

 35 37  0  0  0  0  0  0  0  0999 V2000
   10.0800    7.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2924    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2924    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0800    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0800    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7388    2.6694    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3062    4.0009    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9368    4.2920    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   12.5048    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    8.8675    0.7000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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  6 20  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  2  0  0  0  0
 10 22  2  0  0  0  0
  6 22  1  0  0  0  0
 23 12  1  6  0  0  0
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 16 25  2  0  0  0  0
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 24 33  2  0  0  0  0
 24 34  1  0  0  0  0
 11 35  2  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1014280-3D
FYIcenter.com

 68 70  0  0  1  0  0  0  0  0999 V2000
    0.7134   -4.5304    1.7138 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.0663    3.8555    1.5116 C   0  0  2  0  0  0  0  0  0  0  0  0
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M  END
$$$$

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