Molecule FYI-1015054

A

Molecule Summary:

ID: FYI-1015054
Names:
InChIKey: PWFLZHDOOXMJNR-RDXCRGQUSA-N
SMILES: C[C@@H]3C[C@H](C)CN([C@H](C(=O)O)c1c[nH]c2ccc(NC(=O)CCC(=O)O)cc12)C3

Received at FYIcenter.com on: 2025-06-19

Molecule ID: FYI-1015054 Edit

Molecule Structure InChIKey: PWFLZHDOOXMJNR-RDXCRGQUSA-N

Molecule Structure SMILES String: C[C@@H]3C[C@H](C)CN([C@H](C(=O)O)c1c[nH]c2ccc(NC(=O)CCC(=O)O)cc12)C3

Download SDF Download SVG Structure in 2D SDF:

FYI-1015054
FYIcenter.com

 29 31  0  0  1  0  0  0  0  0999 V2000
    1.8123    5.6169    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2449    4.2855    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3082    3.2451    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7408    1.9137    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8040    0.8732    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1102    1.6226    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0470    2.6629    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.4165    2.3719    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8491    1.0405    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.0000   11.0817    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124   13.1817    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    5.4817    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0621    4.7817    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6144    3.9945    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  6  0  0  0
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 28 15  1  0  0  0  0
 29  7  1  0  0  0  0
 29  2  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1015054-3D
FYIcenter.com

 56 58  0     1  0  0  0  0  0999 V2000
   -2.0270   -0.3091    3.3428 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7218    0.9824    2.5847 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7437   -0.8311    0.5097 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2170   -3.2139    0.5599 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.7158   -1.1526   -0.2515 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.8442    3.5139   -0.4525 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.1995    1.2826   -0.4177 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5320   -2.6164   -0.1133 C   0  0  2  0  0  0  0  0  0  0  0  0
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 28 55  1  0  0  0  0
M  END
$$$$

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2025-06-21, 1136👍, 0💬