Molecule FYI-1007056

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A

Molecule Summary:

ID: FYI-1007056
Names:
InChIKey: AMUNHVYMMLMGOT-UHFFFAOYSA-N
SMILES: C2=Cc3cc1ccccc1c4cccc(C2)c34

Received at FYIcenter.com on: 2024-01-27

Molecule ID: FYI-1007056 Edit

Molecule Structure InChIKey: AMUNHVYMMLMGOT-UHFFFAOYSA-N

Molecule Structure SMILES String: C2=Cc3cc1ccccc1c4cccc(C2)c34

Download SDF Download SVG Structure in 2D SDF:

FYI-1007056
FYIcenter.com

 17 20  0  0  0  0  0  0  0  0999 V2000
    6.0623    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8498    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8498    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0623    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2747    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2747    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0623    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8499    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6374    4.2001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6374    2.8001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    2.1001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2125    2.8001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.1002    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.7002    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    0.7001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  6  2  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  2  0  0  0  0
  9 10  1  0  0  0  0
  3 10  2  0  0  0  0
  4  7  2  0  0  0  0
 10 11  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  2  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
 11 16  1  0  0  0  0
 11 12  2  0  0  0  0
 16 17  1  0  0  0  0
  2 17  2  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1007056-3D
FYIcenter.com

 29 32  0     0  0  0  0  0  0999 V2000
    1.0187    0.0153   -0.0001 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0552    0.9478   -0.0002 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3603    0.4698    0.0001 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7438   -1.3650   -0.0003 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4123    0.4675   -0.0002 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5188   -0.5051    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6515   -0.9296    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5761   -1.8222   -0.0001 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8347   -2.3482   -0.0003 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2878    2.3222   -0.0001 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6460    1.8386    0.0004 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1111   -1.9465    0.0003 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6125    2.7609    0.0003 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5561    1.3064   -0.0004 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9647   -1.4315    0.0004 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8568    0.7950   -0.0001 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0611   -0.5754    0.0005 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1350   -0.3204   -0.8882 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1353   -0.3201    0.8879 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7693   -2.8950   -0.0001 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5905   -3.4051   -0.0003 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4781    3.0935   -0.0002 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6753    2.1873    0.0006 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9012   -2.6921    0.0006 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8314    3.8246    0.0004 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4596    2.3890   -0.0007 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1464   -2.5049    0.0006 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7055    1.4728   -0.0001 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0690   -0.9788    0.0009 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2 10  2  0  0  0  0
  3  6  1  0  0  0  0
  3 11  1  0  0  0  0
  4  8  2  0  0  0  0
  4  9  1  0  0  0  0
  5  7  1  0  0  0  0
  5 14  2  0  0  0  0
  6 12  1  0  0  0  0
  6 18  1  0  0  0  0
  6 19  1  0  0  0  0
  7  8  1  0  0  0  0
  7 15  2  0  0  0  0
  8 20  1  0  0  0  0
  9 12  2  0  0  0  0
  9 21  1  0  0  0  0
 10 13  1  0  0  0  0
 10 22  1  0  0  0  0
 11 13  2  0  0  0  0
 11 23  1  0  0  0  0
 12 24  1  0  0  0  0
 13 25  1  0  0  0  0
 14 16  1  0  0  0  0
 14 26  1  0  0  0  0
 15 17  1  0  0  0  0
 15 27  1  0  0  0  0
 16 17  2  0  0  0  0
 16 28  1  0  0  0  0
 17 29  1  0  0  0  0
M  END
$$$$

✍: FYIcenter.com

2024-02-11, 191👍, 0💬