Molecule FYI-1007954

A

Molecule Summary:

ID: FYI-1007954
Names:
InChIKey: UNUWFIDERHZUHS-UHFFFAOYSA-N
SMILES: c7ccc(Cc6ccc5cc4cc3cc2cc1ccccc1cc2cc3cc4cc5c6)cc7

Received at FYIcenter.com on: 2024-03-21

Molecule ID: FYI-1007954 Edit

Molecule Structure InChIKey: UNUWFIDERHZUHS-UHFFFAOYSA-N

Molecule Structure SMILES String: c7ccc(Cc6ccc5cc4cc3cc2cc1ccccc1cc2cc3cc4cc5c6)cc7

Download SDF Download SVG Structure in 2D SDF:

FYI-1007954
FYIcenter.com

 33 39  0  0  0  0  0  0  0  0999 V2000
    0.0000    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2123    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4247    4.9001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6372    4.2002    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8496    4.9003    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8495    6.3003    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6370    7.0002    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4246    6.3001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0618    7.0004    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0617    8.4004    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8492    9.1003    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6369    8.4002    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2741    9.1005    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    6.0615   11.2004    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8491   10.5003    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4864   11.2006    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    7.2737   13.3005    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0614   12.6004    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6986   13.3007    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6985   14.7007    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4860   15.4006    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2736   14.7005    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9109   15.4008    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9108   16.8008    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6983   17.5007    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4859   16.8006    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  2  1  0  0  0  0
  4  3  2  0  0  0  0
  5  4  1  0  0  0  0
  6  5  2  0  0  0  0
  6  1  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  9 10  1  0  0  0  0
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  8 13  1  0  0  0  0
  8  9  2  0  0  0  0
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 11 14  1  0  0  0  0
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 19 20  1  0  0  0  0
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 22 23  2  0  0  0  0
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 26 27  2  0  0  0  0
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 32 33  2  0  0  0  0
 28 33  1  0  0  0  0
 27 30  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1007954-3D
FYIcenter.com

 55 61  0  0  0  0  0  0  0  0999 V2000
    1.4157   -0.1852   -0.8042 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5473   -0.1041   -1.8821 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8248    0.0762   -1.6807 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3585    0.1724   -0.3878 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8334    0.3847   -0.1509 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6852   -0.8625   -0.0597 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3774   -1.2256    1.1035 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4118   -2.2064    1.0380 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6071   -2.9732   -0.1512 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4315   -4.0959   -0.5593 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7448   -5.3473   -0.8959 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0460   -6.7285   -1.1764 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5278   -7.7001   -0.2359 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8120   -9.0776    0.0144 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0850   -9.3791    0.5149 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.7031  -10.6224    0.6372 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.0142  -10.7047    0.1763 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.6901  -11.9222    0.1567 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.8747  -12.4695   -1.1023 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.0107  -11.5776   -2.1691 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.9004  -10.1751   -1.9296 C   0  0  0  0  0  0  0  0  0  0  0  0
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  8  9  1  0  0  0  0
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 33 55  1  0  0  0  0
M  END
$$$$

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2024-04-14, 153👍, 0💬