Molecule FYI-1016149

A

Molecule Summary:

ID: FYI-1016149
Names:
InChIKey: FAPWSAQOVOBPCP-NSHDSACASA-N
SMILES: O=C2c1ccc(O)cc1OC[C@H]2c4cc3OCOc3cc4O

Received at FYIcenter.com on: 2025-11-28

Molecule ID: FYI-1016149 Edit

Molecule Structure InChIKey: FAPWSAQOVOBPCP-NSHDSACASA-N

Molecule Structure SMILES String: O=C2c1ccc(O)cc1OC[C@H]2c4cc3OCOc3cc4O

Download SDF Download SVG Structure in 2D SDF:

FYI-1016149
FYIcenter.com

 22 25  0  0  1  0  0  0  0  0999 V2000
   10.6414    7.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.4290    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2166    7.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0041    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0041    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7917    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5792    4.9000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.7917    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0041    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2166    2.8000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.2166    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4290    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5792    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3668    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1544    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8229    2.5326    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8229    0.2674    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1544    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3668    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5792    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7917    0.0000    0.0000 O   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  6  1  0  0  0  0
  9  8  1  0  0  0  0
 10  9  1  0  0  0  0
 11 10  1  0  0  0  0
 11  5  1  0  0  0  0
 12 11  2  0  0  0  0
 12  2  1  0  0  0  0
  8 13  1  1  0  0  0
 14 13  2  0  0  0  0
 15 14  1  0  0  0  0
 16 15  1  0  0  0  0
 17 16  1  0  0  0  0
 18 17  1  0  0  0  0
 19 18  1  0  0  0  0
 19 15  2  0  0  0  0
 20 19  1  0  0  0  0
 21 20  2  0  0  0  0
 21 13  1  0  0  0  0
 22 21  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1016149-3D
FYIcenter.com

 34 37  0     1  0  0  0  0  0999 V2000
    2.0447   -1.1081    1.5380 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8292    2.0721    0.7302 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3709    0.3920   -0.0501 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4574    0.5454   -1.8711 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8237   -2.7679   -0.8340 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.3598    0.5379    0.4648 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1055   -0.8555    0.0741 C   0  0  2  0  0  0  0  0  0  0  0  0
   -1.3799   -0.5665    0.0221 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6673   -0.7208    1.4897 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9108    0.0396   -0.8508 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3347    0.2163   -0.4898 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8415    0.6863    0.4333 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8251   -0.3847    0.6736 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2793   -1.5465   -0.4330 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2003    0.9189    0.3745 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0807   -0.0405   -0.0709 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6508   -1.2853   -0.4822 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1913    0.9414   -1.3227 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1822   -0.2887    0.9856 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2042    1.7309    0.4596 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5432    1.0507   -0.9948 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0386    0.4331    0.1539 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3125   -1.8750   -0.2767 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5762    0.2963    1.8936 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1255   -1.3834    2.1749 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1678    1.4618    0.7810 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3586   -2.0296   -0.8308 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8297    1.4163   -2.2303 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5654   -0.7690    1.8827 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7789    1.8271    1.3880 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6030    2.4387   -0.2762 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2087    1.6132   -1.6442 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5798   -3.3119   -1.1138 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.5291    0.0522    1.2903 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  9  1  0  0  0  0
  1 13  1  0  0  0  0
  2 15  1  0  0  0  0
  2 20  1  0  0  0  0
  3 16  1  0  0  0  0
  3 20  1  0  0  0  0
  4 10  2  0  0  0  0
  5 14  1  0  0  0  0
  5 33  1  0  0  0  0
  6 22  1  0  0  0  0
  6 34  1  0  0  0  0
  7  8  1  0  0  0  0
  7  9  1  0  0  0  0
  7 10  1  0  0  0  0
  7 23  1  0  0  0  0
  8 12  2  0  0  0  0
  8 14  1  0  0  0  0
  9 24  1  0  0  0  0
  9 25  1  0  0  0  0
 10 11  1  0  0  0  0
 11 13  2  0  0  0  0
 11 18  1  0  0  0  0
 12 15  1  0  0  0  0
 12 26  1  0  0  0  0
 13 19  1  0  0  0  0
 14 17  2  0  0  0  0
 15 16  2  0  0  0  0
 16 17  1  0  0  0  0
 17 27  1  0  0  0  0
 18 21  2  0  0  0  0
 18 28  1  0  0  0  0
 19 22  2  0  0  0  0
 19 29  1  0  0  0  0
 20 30  1  0  0  0  0
 20 31  1  0  0  0  0
 21 22  1  0  0  0  0
 21 32  1  0  0  0  0
M  END
$$$$

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2026-01-24, 931👍, 0💬