Molecule FYI-1005444

A

Molecule Summary:

ID: FYI-1005444
Names:
InChIKey: YDGSHFJUSTYFRE-PMCHYTPCSA-N
SMILES: CN4CCNC(C(=O)N[C@@H](Cc1ccc(F)cc1)C(=O)N3CCC(C(=O)NC(C)(C)C)(C2CCCCC2)CC3)C4

Received at FYIcenter.com on: 2023-10-29

Molecule ID: FYI-1005444 Edit

Molecule Structure InChIKey: YDGSHFJUSTYFRE-PMCHYTPCSA-N

Molecule Structure SMILES String: CN4CCNC(C(=O)N[C@@H](Cc1ccc(F)cc1)C(=O)N3CCC(C(=O)NC(C)(C)C)(C2CCCCC2)CC3)C4

Download SDF Download SVG Structure in 2D SDF:

FYI-1005444
FYIcenter.com

 40 43  0  0  1  0  0  0  0  0999 V2000
   13.3913    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1740    0.7029    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.9565    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7392    0.7029    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7392    2.1086    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.9565    2.8115    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9565    4.2172    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1740    4.9201    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.7392    4.9201    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.7392    6.3258    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9565    7.0287    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9565    8.4344    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1740    9.1373    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1740   10.5430    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9565   11.2458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9565   12.6515    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
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    7.3044    4.9201    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1740    2.1086    0.0000 C   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
  6  7  1  0  0  0  0
  8  7  2  0  0  0  0
  9  7  1  0  0  0  0
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 37 32  1  0  0  0  0
 38 24  1  0  0  0  0
 39 38  1  0  0  0  0
 39 21  1  0  0  0  0
 40  6  1  0  0  0  0
 40  2  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1005444-3D
FYIcenter.com

 88 91  0  0  1  0  0  0  0  0999 V2000
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M  END
$$$$

✍: FYIcenter.com

2023-11-09, 361👍, 0💬