Molecule FYI-1014064

A

Molecule Summary:

ID: FYI-1014064
Names:
InChIKey: YWEWWNPYDDHZDI-JJKKTNRVSA-N
SMILES: Cc4ccc(C3OC[C@@H]2OC(c1ccc(C)c(C)c1)O[C@H]([C@H](O)CO)[C@@H]2O3)cc4C

Received at FYIcenter.com on: 2025-02-26

Molecule ID: FYI-1014064 Edit

Molecule Structure InChIKey: YWEWWNPYDDHZDI-JJKKTNRVSA-N

Molecule Structure SMILES String: Cc4ccc(C3OC[C@@H]2OC(c1ccc(C)c(C)c1)O[C@H]([C@H](O)CO)[C@@H]2O3)cc4C

Download SDF Download SVG Structure in 2D SDF:

FYI-1014064
FYIcenter.com

 30 33  0  0  1  0  0  0  0  0999 V2000
    6.0621    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0621    1.4000    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    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0621    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0621    5.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2747    6.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2747    7.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0621    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.8497    6.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    2.4249    7.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    7.7000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    6.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
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  4  3  1  0  0  0  0
  5  4  2  0  0  0  0
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 11 17  1  1  0  0  0
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 26 14  1  0  0  0  0
 27 26  1  0  0  0  0
 28 27  1  0  0  0  0
 26 29  1  6  0  0  0
 30  3  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1014064-3D
FYIcenter.com

 60 63  0     1  0  0  0  0  0999 V2000
    0.8570    0.0666    0.5516 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3155    1.0283   -1.1058 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5518   -1.2296   -0.3849 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0065    2.3761   -0.0308 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5959   -3.0474   -0.3535 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0912   -4.9366    0.8359 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6645   -0.3357   -0.8097 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.0127    0.8041   -1.5927 C   0  0  2  0  0  0  0  0  0  0  0  0
   -0.2378   -1.5775   -0.8333 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.8014    2.0926   -1.4142 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2769   -2.6981    0.0611 C   0  0  1  0  0  0  0  0  0  0  0  0
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    3.8652    2.2405    0.1272 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8798    0.8825    1.2027 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$

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2025-03-12, 1378👍, 0💬