Molecule FYI-1014114

A

Molecule Summary:

ID: FYI-1014114
Names:
InChIKey: VAAHKRMGOFIORX-IKTBLOROSA-N
SMILES: CCC[C@H](O)CC(=O)SCCNC(=O)CCNC(=O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n2cnc1c(N)ncnc12)[C@H](O)[C@@H]3OP(=O)(O)O

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

Molecule ID: FYI-1014114 Edit

Molecule Structure InChIKey: VAAHKRMGOFIORX-IKTBLOROSA-N

Molecule Structure SMILES String: CCC[C@H](O)CC(=O)SCCNC(=O)CCNC(=O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n2cnc1c(N)ncnc12)[C@H](O)[C@@H]3OP(=O)(O)O

Download SDF Download SVG Structure in 2D SDF:

FYI-1014114
FYIcenter.com

 56 58  0  0  1  0  0  0  0  0999 V2000
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   20.0991    0.1876    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.6115    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.8239    1.4000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   23.0364    2.1000    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
   23.7364    3.3124    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   22.3364    3.3124    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    3.6373    3.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    0.0000    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 11 10  2  0  0  0  0
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 13 10  1  0  0  0  0
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 15 14  1  1  0  0  0
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 17 16  1  0  0  0  0
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 27 26  2  0  0  0  0
 27 21  1  0  0  0  0
 27 18  1  0  0  0  0
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 28 29  1  6  0  0  0
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 54 52  1  0  0  0  0
 55 54  1  0  0  0  0
 56 55  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1014114-3D
FYIcenter.com

102104  0  0  1  0  0  0  0  0999 V2000
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M  END
$$$$

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2025-03-12, 495👍, 0💬