Molecule Editor

Molecule ID: FYI-1004479 Edit

Molecule Names: MONOPALMITIN;

Molecule Structure InChIKey: QHZLMUACJMDIAE-UHFFFAOYSA-N

Molecule Structure SMILES String: CCCCCCCCCCCCCCCC(=O)OCC(O)CO

Download SDF Download SVG Structure in 2D SDF:

FYI-1004479
FYIcenter.com

 23 22  0  0  0  0  0  0  0  0999 V2000
    0.0000    2.0964    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    1.3965    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4248    2.0965    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    1.3965    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    2.0964    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0621    1.3964    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    2.0964    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4870    1.3964    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    2.0964    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119    1.3964    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   19.3989    2.0964    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   23.0362    1.3964    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.0933    2.3143    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   22.2612    3.4263    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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 20 21  1  0  0  0  0
 19 22  1  0  0  0  0
 16 23  2  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1004479-3D
FYIcenter.com

 61 60  0  0  1  0  0  0  0  0999 V2000
    0.9629   -0.1028    0.0505 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4801   -0.0969    0.0466 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0097    0.4930   -1.2541 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5308    0.4993   -1.2635 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0471    1.0884   -2.5675 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5666    1.0926   -2.5770 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0804    1.6796   -3.8807 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5996    1.6844   -3.8874 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1138    2.2730   -5.1900 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6336    2.2773   -5.1993 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1468    2.8687   -6.5033 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6681    2.8764   -6.5215 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1842    3.4667   -7.8287 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7056    3.4675   -7.8393 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2724    4.0347   -9.1363 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.7778    4.0208   -9.0836 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.4390    3.6095   -8.1394 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.2971    4.6107  -10.2002 O   0  0  0  0  0  0  0  0  0  0  0  0
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   18.4166    6.5857   -9.4122 C   0  0  3  0  0  0  0  0  0  0  0  0
   17.7106    6.4572   -8.1659 O   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$