Molecule FYI-1008879

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A

Molecule Summary:

ID: FYI-1008879
Names:
InChIKey: LHCPRYRLDOSKHK-UHFFFAOYSA-N
SMILES: Nc1ncnc2n[nH]cc12

Received at FYIcenter.com on: 2024-04-28

Molecule ID: FYI-1008879 Edit

Molecule Structure InChIKey: LHCPRYRLDOSKHK-UHFFFAOYSA-N

Molecule Structure SMILES String: Nc1ncnc2n[nH]cc12

Download SDF Download SVG Structure in 2D SDF:

FYI-1008879
FYIcenter.com

 10 11  0  0  0  0  0  0  0  0999 V2000
    3.6373    4.3157    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    3.6157    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2125    4.3157    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    3.6157    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.2157    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.2125    1.5157    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5035    0.1463    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.8959    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.4653    1.2789    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    2.2157    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  2  0  0  0  0
  4  3  1  0  0  0  0
  5  4  2  0  0  0  0
  6  5  1  0  0  0  0
  7  6  2  0  0  0  0
  8  7  1  0  0  0  0
  9  8  1  0  0  0  0
 10  9  2  0  0  0  0
 10  2  1  0  0  0  0
 10  6  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1008879-3D
FYIcenter.com

 15 16  0     0  0  0  0  0  0999 V2000
    1.9689    0.7217    0.0001 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.4628   -0.5305    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1623    1.8709    0.0001 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0319    0.3038    0.0001 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7211   -2.0672    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.1774   -0.5454    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6064    0.7703   -0.0001 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1964   -0.7626    0.0001 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3670   -1.2975   -0.0001 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4709    1.5366   -0.0002 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4869   -2.3717   -0.0002 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6204    1.4964    0.0002 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1682    2.3676   -0.0001 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1056   -2.8691   -0.0005 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7241   -2.1939   -0.0005 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  7  1  0  0  0  0
  1 12  1  0  0  0  0
  2  9  2  0  0  0  0
  3  7  2  0  0  0  0
  3 10  1  0  0  0  0
  4  8  1  0  0  0  0
  4 10  2  0  0  0  0
  5  8  1  0  0  0  0
  5 14  1  0  0  0  0
  5 15  1  0  0  0  0
  6  7  1  0  0  0  0
  6  8  2  0  0  0  0
  6  9  1  0  0  0  0
  9 11  1  0  0  0  0
 10 13  1  0  0  0  0
M  END
$$$$

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2024-06-03, 1597👍, 0💬