Molecule FYI-1014255

A

Molecule Summary:

ID: FYI-1014255
Names:
InChIKey: JLOCFOYOXCDWTJ-FIFLTTCUSA-N
SMILES: CC1(C)COCC(C)(C)COC(=O)/C=C/C(=O)OCC(C)(C)COC(=O)/C=C/C(=O)OC1

Received at FYIcenter.com on: 2025-03-17

Molecule ID: FYI-1014255 Edit

Molecule Structure InChIKey: JLOCFOYOXCDWTJ-FIFLTTCUSA-N

Molecule Structure SMILES String: CC1(C)COCC(C)(C)COC(=O)/C=C/C(=O)OCC(C)(C)COC(=O)/C=C/C(=O)OC1

Download SDF Download SVG Structure in 2D SDF:

FYI-1014255
FYIcenter.com

 32 32  0  0  0  0  0  0  0  0999 V2000
    2.6124    3.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.6124    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4000    1.4000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.8249    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0373    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2498    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2498    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    8.6747    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.0746    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    9.8871    6.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    0.0000    5.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4000    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
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 10  9  1  0  0  0  0
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 28 27  1  0  0  0  0
 29 28  1  0  0  0  0
 30 29  1  0  0  0  0
 31 29  1  0  0  0  0
 32 29  1  0  0  0  0
 32  1  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1014255-3D
FYIcenter.com

 66 66  0  0  0  0  0  0  0  0999 V2000
    0.0321   -0.4106    5.0230 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4478   -0.2982    5.7831 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8536    1.1815    5.5537 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$

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2025-04-11, 1367👍, 0💬