Molecule FYI-1004208

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Molecule Summary:

ID: FYI-1004208
Names:
InChIKey: GYNYBVOAJFHCRG-UHFFFAOYSA-N
SMILES: OC1COC2OC1C(O)C2O

Received at FYIcenter.com on: 2023-08-22

Molecule ID: FYI-1004208 Edit

Molecule Structure InChIKey: GYNYBVOAJFHCRG-UHFFFAOYSA-N

Molecule Structure SMILES String: OC1COC2OC1C(O)C2O

Download SDF Download SVG Structure in 2D SDF:

FYI-1004208
FYIcenter.com

 11 12  0  0  0  0  0  0  0  0999 V2000
    3.2566    4.9524    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9439    4.8145    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2812    3.1407    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1431    1.8280    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3490    1.2912    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2322    2.2721    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0325    3.8846    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5722    3.4152    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.6234    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    1.1680    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1459    5.8660    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  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  0  0  0  0
  7  1  1  0  0  0  0
  8  6  1  0  0  0  0
  8  3  1  0  0  0  0
  9  5  1  0  0  0  0
 10  4  1  0  0  0  0
 11  2  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1004208-3D
FYIcenter.com

 21 22  0     1  0  0  0  0  0999 V2000
   -0.1266    0.6481   -1.3106 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5744    1.5511    0.8083 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8877   -2.0717    0.7470 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7490    0.5729   -0.2090 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7021   -0.2217   -0.5586 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3642   -0.6972   -0.8539 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.9854   -1.0653   -0.2413 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.4784    0.2567    0.3523 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.4516    1.2743   -0.1527 C   0  0  1  0  0  0  0  0  0  0  0  0
   -1.5261   -0.6268    0.1467 C   0  0  1  0  0  0  0  0  0  0  0  0
   -1.2587    0.3796    1.2718 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6220   -1.3251   -1.7126 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6716   -1.4188   -1.0203 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5856    0.2467    1.4406 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9020    2.2246   -0.4549 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7446   -1.6117    0.5713 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1955    0.7120    1.7311 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6524   -0.0764    2.0617 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4975   -2.8565    0.3259 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6473    0.6417   -1.1739 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5303    0.6578   -0.9369 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  6  1  0  0  0  0
  1  9  1  0  0  0  0
  2  9  1  0  0  0  0
  2 11  1  0  0  0  0
  3  7  1  0  0  0  0
  3 19  1  0  0  0  0
  4  8  1  0  0  0  0
  4 20  1  0  0  0  0
  5 10  1  0  0  0  0
  5 21  1  0  0  0  0
  6  7  1  0  0  0  0
  6 10  1  0  0  0  0
  6 12  1  0  0  0  0
  7  8  1  0  0  0  0
  7 13  1  0  0  0  0
  8  9  1  0  0  0  0
  8 14  1  0  0  0  0
  9 15  1  0  0  0  0
 10 11  1  0  0  0  0
 10 16  1  0  0  0  0
 11 17  1  0  0  0  0
 11 18  1  0  0  0  0
M  END
$$$$

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2023-09-10, 1892👍, 0💬