Molecule FYI-1010320

A

Molecule Summary:

ID: FYI-1010320
Names:
InChIKey: DANUORFCFTYTSZ-SJSJOXFOSA-N
SMILES: CO[C@@H]6C[C@@H](C[C@H]1CC[C@H](C)[C@H]([C@@H](C)C(=O)O)O1)O[C@]5(O[C@](C)([C@H]4CC[C@@](C)([C@@H]3O[C@@H]([C@H]2O[C@@](O)(CO)[C@H](C)C[C@@H]2C)C[C@@H]3C)O4)C[C@H]5C)[C@@H]6C

Received at FYIcenter.com on: 2024-06-05

Molecule ID: FYI-1010320 Edit

Molecule Structure InChIKey: DANUORFCFTYTSZ-SJSJOXFOSA-N

Molecule Structure SMILES String: CO[C@@H]6C[C@@H](C[C@H]1CC[C@H](C)[C@H]([C@@H](C)C(=O)O)O1)O[C@]5(O[C@](C)([C@H]4CC[C@@](C)([C@@H]3O[C@@H]([C@H]2O[C@@](O)(CO)[C@H](C)C[C@@H]2C)C[C@@H]3C)O4)C[C@H]5C)[C@@H]6C

Download SDF Download SVG Structure in 2D SDF:

FYI-1010320
FYIcenter.com

 51 56  0  0  1  0  0  0  0  0999 V2000
   17.6907    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.6907    1.4012    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.9042    2.1019    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.9042    3.5031    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.6907    4.2037    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.4772    3.5031    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.4772    2.1019    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2637    1.4012    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   14.0503    3.5031    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.8367    1.4012    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   15.2637    5.6050    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.7702    6.8754    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8326    5.8342    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5331    4.6207    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9037    4.9120    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.9632    3.3406    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1339    4.5473    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2521    5.6362    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9439    5.1341    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0172    3.7348    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3707    3.3721    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.9283    2.8530    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7372    4.3047    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4458    5.6753    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0523    5.8218    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4823    4.5417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5237    3.6042    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.1117    4.2504    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1742    5.2917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8036    5.0004    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3705    3.6677    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3081    2.6264    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6787    2.9178    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8752    1.2938    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5046    1.0025    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9375    2.3351    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    3.3764    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6072    6.6244    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3834    6.7167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3384    8.1828    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9069    8.4390    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2637    9.8086    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.0503   10.5092    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  6  0  0  0
  3  2  1  0  0  0  0
  4  3  1  0  0  0  0
  5  4  1  0  0  0  0
  6  5  1  0  0  0  0
  7  6  1  6  0  0  0
  7  2  1  0  0  0  0
  8  7  1  0  0  0  0
  8  9  1  1  0  0  0
 10  8  1  0  0  0  0
 11 10  2  0  0  0  0
 12 10  1  0  0  0  0
  5 13  1  1  0  0  0
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 26 25  1  0  0  0  0
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 25 29  1  6  0  0  0
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 34 33  1  0  0  0  0
 34 35  1  1  0  0  0
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 36 34  1  0  0  0  0
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 40 44  1  6  0  0  0
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 37 46  1  6  0  0  0
 32 47  1  6  0  0  0
 20 48  1  1  0  0  0
 17 49  1  6  0  0  0
 16 50  1  6  0  0  0
 51 50  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1010320-3D
FYIcenter.com

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