Molecule FYI-1006058

A

Molecule Summary:

ID: FYI-1006058
Names:
InChIKey: VESMNBJXHLZHQO-AIJKTPEZSA-Q
SMILES: C[C@H]6CCC[N@@H+](Cc5cc4C(=O)[NH+](c3cccc([C@@]2(C1NNC[NH+]1C)C[C@H](C)C2)c3)Cc4c(C(F)(F)F)c5)C6

Received at FYIcenter.com on: 2023-11-25

Molecule ID: FYI-1006058 Edit

Molecule Structure InChIKey: VESMNBJXHLZHQO-AIJKTPEZSA-Q

Molecule Structure SMILES String: C[C@H]6CCC[N@@H+](Cc5cc4C(=O)[NH+](c3cccc([C@@]2(C1NNC[NH+]1C)C[C@H](C)C2)c3)Cc4c(C(F)(F)F)c5)C6

Download SDF Download SVG Structure in 2D SDF:

FYI-1006058
FYIcenter.com

 39 44  0  0  1  0  0  0  0  0999 V2000
   14.1499    2.5599    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1499    3.9642    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3661    4.6663    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3661    6.0706    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1499    6.7728    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9338    6.0706    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   11.7176    6.7728    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5014    6.0706    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    6.1918    7.7954    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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 37  8  2  0  0  0  0
 38  6  1  0  0  0  0
 38  2  1  0  0  0  0
 11 39  2  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1006058-3D
FYIcenter.com

 80 85  0  0  1  0  0  0  0  0999 V2000
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M  END
$$$$

✍: FYIcenter.com

2023-12-01, 2508👍, 0💬