Molecule Editor

Molecule ID: FYI-1005595 Edit

Molecule Structure InChIKey: GUBGYTABKSRVRQ-UHFFFAOYSA-N

Molecule Structure SMILES String: OCC2OC(OC1C(O)C(O)C(O)OC1CO)C(O)C(O)C2O

Download SDF Download SVG Structure in 2D SDF:

FYI-1005595
FYIcenter.com

 23 24  0  0  0  0  0  0  0  0999 V2000
    1.2124    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    1.4000    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
    4.8497    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    4.2000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0621    4.2000    0.0000 O   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 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2747    7.7000    0.0000 O   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
    4.8497    7.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    5.6000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    8.4000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0621    9.8000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871    5.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    6.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0621    1.4000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    1.4000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    3.5000    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  2  1  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
 12 11  1  0  0  0  0
 13 12  1  0  0  0  0
 14 13  1  0  0  0  0
 14  9  1  0  0  0  0
 15 14  1  0  0  0  0
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 17 12  1  0  0  0  0
 18 10  1  0  0  0  0
 19 18  1  0  0  0  0
 20  5  1  0  0  0  0
 21  4  1  0  0  0  0
 22  3  1  0  0  0  0
 23  1  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1005595-3D
FYIcenter.com

 45 46  0  0  1  0  0  0  0  0999 V2000
    1.1179   -0.7122    0.4301 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4059   -0.1848    0.1219 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7749   -0.3637   -1.3639 C   0  0  3  0  0  0  0  0  0  0  0  0
    1.9426    0.4230   -2.2315 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6182   -0.0783   -2.4096 C   0  0  3  0  0  0  0  0  0  0  0  0
   -0.1333    0.8207   -3.2574 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1080    2.1937   -2.7955 C   0  0  3  0  0  0  0  0  0  0  0  0
   -0.8438    2.3940   -1.4462 C   0  0  3  0  0  0  0  0  0  0  0  0
   -0.4021    3.5920   -0.7803 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3755    2.4240   -1.5952 C   0  0  3  0  0  0  0  0  0  0  0  0
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   -2.1460    3.0137   -3.9499 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7256    3.1370   -3.8568 C   0  0  3  0  0  0  0  0  0  0  0  0
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    3.0558   -3.3826   -0.6504 H   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$