Molecule FYI-1002994

A

Molecule Summary:

ID: FYI-1002994
Names:
InChIKey: ZXMXRXCCHDGDFA-UHFFFAOYSA-N
SMILES: COc5cccc(c4cc(Nc1cc(O)cc(O)c1C(=O)N3Cc2ccccc2C3)n(C)n4)c5

Received at FYIcenter.com on: 2023-05-04

Molecule ID: FYI-1002994 Edit

Molecule Structure InChIKey: ZXMXRXCCHDGDFA-UHFFFAOYSA-N

Molecule Structure SMILES String: COc5cccc(c4cc(Nc1cc(O)cc(O)c1C(=O)N3Cc2ccccc2C3)n(C)n4)c5

Download SDF Download SVG Structure in 2D SDF:

FYI-1002994
FYIcenter.com

 34 38  0  0  0  0  0  0  0  0999 V2000
    0.0000    5.5298    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.6226    7.3318    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9136    8.7013    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2451    9.1339    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2855    8.1971    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9945    6.8277    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6630    6.3950    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.8885    4.4986    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
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 34  9  2  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1002994-3D
FYIcenter.com

 58 62  0     0  0  0  0  0  0999 V2000
    3.6183    1.4055   -2.1536 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.1846    3.1986    0.6201 O   0  0  0  0  0  0  0  0  0  0  0  0
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    3.5514   -0.0374   -0.3316 N   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.8454    0.2471   -1.2991 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$

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2023-05-31, 2678👍, 0💬