Molecule FYI-1015725

A

Molecule Summary:

ID: FYI-1015725
Names:
InChIKey: JEJVFMSPDSIACM-UHFFFAOYSA-N
SMILES: CC1OC(=O)C(C)OC(=O)CCCCC(=O)OCCCCOC1=O

Received at FYIcenter.com on: 2025-10-01

Molecule ID: FYI-1015725 Edit

Molecule Structure InChIKey: JEJVFMSPDSIACM-UHFFFAOYSA-N

Molecule Structure SMILES String: CC1OC(=O)C(C)OC(=O)CCCCC(=O)OCCCCOC1=O

Download SDF Download SVG Structure in 2D SDF:

FYI-1015725
FYIcenter.com

 24 24  0  0  0  0  0  0  0  0999 V2000
    7.2747    5.6000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8498    5.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    7.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2747    8.4000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8498    8.4000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6374    7.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6374    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    9.8000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2125    7.7000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2125    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.0000    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.2125    2.1000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    4.8498    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    7.2747    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871    3.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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 23 22  1  0  0  0  0
 23  1  1  0  0  0  0
 24 23  2  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1015725-3D
FYIcenter.com

 48 48  0  0  1  0  0  0  0  0999 V2000
    0.9384   -0.0258   -0.0951 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4318   -0.0864    0.1382 C   0  0  3  0  0  0  0  0  0  0  0  0
    3.1027    1.0487   -0.4520 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5936    1.9675    0.4221 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1662    2.1282    1.5577 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8824    2.5816   -0.1358 C   0  0  3  0  0  0  0  0  0  0  0  0
    4.6911    3.2447   -1.4903 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4069    3.5444    0.7908 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7624    3.5740    0.8605 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4297    4.4103    0.2814 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.3074    2.5188    1.8004 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8324    2.3947    1.7085 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3635    1.1481    2.4254 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1156   -0.1315    1.6228 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3548   -1.3839    2.4378 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8637   -1.4317    3.5467 O   0  0  0  0  0  0  0  0  0  0  0  0
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    7.0002   -3.5821    0.8469 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4690   -3.5931    0.8912 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8715   -2.6874   -0.1839 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6723   -2.0906    0.3219 O   0  0  0  0  0  0  0  0  0  0  0  0
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    5.5616   -1.8688   -0.4229 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
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  1 27  1  0  0  0  0
  2  3  1  0  0  0  0
  2 23  1  0  0  0  0
  2 28  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  4  6  1  0  0  0  0
  6  7  1  0  0  0  0
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  6 29  1  0  0  0  0
  7 30  1  0  0  0  0
  7 31  1  0  0  0  0
  7 32  1  0  0  0  0
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  9 10  2  0  0  0  0
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 14 39  1  0  0  0  0
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 15 16  2  0  0  0  0
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 17 18  1  0  0  0  0
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 21 48  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  2  0  0  0  0
M  END
$$$$

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2025-10-14, 597👍, 0💬