Molecule FYI-1014381

A

Molecule Summary:

ID: FYI-1014381
Names:
InChIKey: ANYXTFBIDABDRD-UHFFFAOYSA-N
SMILES: C#CC[Se+](CCNC1C(=O)C(=O)C1O)CC4OC(n3cnc2c(N)ncnc23)C(O)C4O

Received at FYIcenter.com on: 2025-04-09

Molecule ID: FYI-1014381 Edit

Molecule Structure InChIKey: ANYXTFBIDABDRD-UHFFFAOYSA-N

Molecule Structure SMILES String: C#CC[Se+](CCNC1C(=O)C(=O)C1O)CC4OC(n3cnc2c(N)ncnc23)C(O)C4O

Download SDF Download SVG Structure in 2D SDF:

FYI-1014381
FYIcenter.com

 32 35  0  0  0  0  0  0  0  0999 V2000
   13.0852    0.7802    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8728    1.4802    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6604    2.1802    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6604    3.5802    0.0000 Se  0  3  0  0  0  0  0  0  0  0  0  0
   11.8728    4.2803    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0852    3.5802    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2976    4.2803    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   15.5102    3.5802    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.8725    2.2280    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   18.4372    1.8903    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.8624    3.9426    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    9.1295    1.2510    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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 31 29  1  0  0  0  0
 31 16  1  0  0  0  0
 32 31  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1014381-3D
FYIcenter.com

 55 58  0  0  1  0  0  0  0  0999 V2000
    1.2599   -0.3858    0.5599 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4319   -0.1443    0.4024 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8586    0.1606    0.2345 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3133    1.8212    1.1928 Se  0  3  3  0  0  0  0  0  0  0  0  0
    3.8231    1.0830    2.9681 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9197    2.1078    4.1240 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2941    2.4986    4.4914 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.1991    1.3555    4.7558 C   0  0  3  0  0  0  0  0  0  0  0  0
    5.9726    0.6755    6.0385 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9577    0.2610    6.5755 O   0  0  0  0  0  0  0  0  0  0  0  0
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    7.8789    4.7351    1.3288 C   0  0  3  0  0  0  0  0  0  0  0  0
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    6.2524    6.5481    2.1061 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2803    7.8554    2.4888 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.5881    8.1738    2.4319 C   0  0  0  0  0  0  0  0  0  0  0  0
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    7.5237   10.5498    3.0487 N   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$

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2025-04-26, 1424👍, 0💬