Molecule FYI-1017389

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A

Molecule Summary:

ID: FYI-1017389
Names:
InChIKey: ZXXDDSPXEBOXDR-FNORWQNLSA-N
SMILES: COC(=O)/C(C)=C/CC(C)C(=O)OC

Received at FYIcenter.com on: 2026-07-01

Molecule ID: FYI-1017389 Edit

Molecule Structure InChIKey: ZXXDDSPXEBOXDR-FNORWQNLSA-N

Molecule Structure SMILES String: COC(=O)/C(C)=C/CC(C)C(=O)OC

Download SDF Download SVG Structure in 2D SDF:

FYI-1017389
FYIcenter.com

 14 13  0  0  0  0  0  0  0  0999 V2000
    4.8497    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0621    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2747    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2747    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871    2.1000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0620    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    2.1000    0.0000 C   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
    1.2124    2.1000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8007    0.7096    0.0000 C   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  2  0  0  0  0
  5  3  1  0  0  0  0
  6  5  1  0  0  0  0
  2  7  1  0  0  0  0
  9  8  2  0  0  0  0
 10  9  1  0  0  0  0
 11 10  2  0  0  0  0
 12 10  1  0  0  0  0
 13 12  1  0  0  0  0
  9 14  1  0  0  0  0
  1  8  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1017389-3D
FYIcenter.com

 30 29  0     1  0  0  0  0  0999 V2000
   -2.2024    1.1265    0.5580 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9503    0.9970   -1.7313 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0690    0.8213    0.1039 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9351   -1.2496   -0.8929 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2362   -1.0264   -0.4118 C   0  0  1  0  0  0  0  0  0  0  0  0
   -1.1405   -1.5085    0.5501 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6252   -1.3450    0.1402 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2441   -1.2375    0.0221 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1195    0.4728   -0.6376 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2019   -0.4864    0.5970 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0974    0.2032    1.9250 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4880   -0.3818   -0.1566 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0763    2.5503    0.4917 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3150    1.0642   -0.5578 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1206   -1.5184   -1.3859 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2927   -1.0722    1.5415 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2366   -2.5939    0.6826 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4051   -0.9525   -0.5215 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7824   -0.9058    1.1315 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7667   -2.4275    0.2256 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4465   -1.7075   -0.9398 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3156   -0.2126    2.5646 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0352    0.1024    2.4825 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8938    1.2694    1.7835 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0970    2.8247    0.0882 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1604    2.9462    1.5072 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8796    2.9739   -0.1185 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1768    1.0480   -1.6431 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0576    0.3216   -0.2509 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6681    2.0561   -0.2637 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  9  1  0  0  0  0
  1 13  1  0  0  0  0
  2  9  2  0  0  0  0
  3 12  1  0  0  0  0
  3 14  1  0  0  0  0
  4 12  2  0  0  0  0
  5  6  1  0  0  0  0
  5  7  1  0  0  0  0
  5  9  1  0  0  0  0
  5 15  1  0  0  0  0
  6  8  1  0  0  0  0
  6 16  1  0  0  0  0
  6 17  1  0  0  0  0
  7 18  1  0  0  0  0
  7 19  1  0  0  0  0
  7 20  1  0  0  0  0
  8 10  2  0  0  0  0
  8 21  1  0  0  0  0
 10 11  1  0  0  0  0
 10 12  1  0  0  0  0
 11 22  1  0  0  0  0
 11 23  1  0  0  0  0
 11 24  1  0  0  0  0
 13 25  1  0  0  0  0
 13 26  1  0  0  0  0
 13 27  1  0  0  0  0
 14 28  1  0  0  0  0
 14 29  1  0  0  0  0
 14 30  1  0  0  0  0
M  END
$$$$

✍: FYIcenter.com

2026-07-13, 442👍, 0💬