Molecule FYI-1014228

A

Molecule Summary:

ID: FYI-1014228
Names:
InChIKey: CHBITXAMNKHJCR-VGYCLGPVSA-N
SMILES: O=C6OC[C@@H](O)[C@H]([C@@H]3OC(=O)c1cc(O)c(O)c(O)c1c2c(O)c(O)c(O)c4c2C(=O)O[C@H]3[C@H]4O)OC(=O)c5cc(O)c(O)c(O)c5c7c(O)c(O)c(O)cc67

Received at FYIcenter.com on: 2025-03-13

Molecule ID: FYI-1014228 Edit

Molecule Structure InChIKey: CHBITXAMNKHJCR-VGYCLGPVSA-N

Molecule Structure SMILES String: O=C6OC[C@@H](O)[C@H]([C@@H]3OC(=O)c1cc(O)c(O)c(O)c1c2c(O)c(O)c(O)c4c2C(=O)O[C@H]3[C@H]4O)OC(=O)c5cc(O)c(O)c(O)c5c7c(O)c(O)c(O)cc67

Download SDF Download SVG Structure in 2D SDF:

FYI-1014228
FYIcenter.com

 56 62  0  0  1  0  0  0  0  0999 V2000
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    3.3036    6.6388    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    1.5979    5.3731    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.8390    4.1209    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5382    3.4599    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.7368    1.3840    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.9353    3.4599    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.1819    8.9055    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2010    8.8319    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1993    7.4479    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3972    6.7545    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.6776    4.7639    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7926    5.3680    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7942    6.7519    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5308    7.4898    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7742    8.8305    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7088    9.4984    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3974    9.5649    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5072    7.9176    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3258    6.9324    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7983    7.2357    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2405    8.3745    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4079    9.4800    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0342    9.3115    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2016   10.4170    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7426   11.6908    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.8279   10.2488    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.6142    8.5429    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5461    6.0400    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.7848    5.6584    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.9905    4.6746    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5970    3.2843    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1963    4.6800    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
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  6  5  2  0  0  0  0
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 11 10  1  0  0  0  0
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 54 32  1  0  0  0  0
 30 55  1  6  0  0  0
  2 56  1  6  0  0  0
M  END
$$$$

Molecule Structure in 3D: Not available

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2025-04-11, 261👍, 0💬