Molecule FYI-1010865

A

Molecule Summary:

ID: FYI-1010865
Names:
InChIKey: NSVICYIIAALIHO-WYMLVPIESA-N
SMILES: CCCCCCCC(C)CC(C/C=C/CCC(=O)NC(COC)C(O)C1=CC(C)C(O)C(C)(C)C1=O)OC

Received at FYIcenter.com on: 2024-07-16

Molecule ID: FYI-1010865 Edit

Molecule Structure InChIKey: NSVICYIIAALIHO-WYMLVPIESA-N

Molecule Structure SMILES String: CCCCCCCC(C)CC(C/C=C/CCC(=O)NC(COC)C(O)C1=CC(C)C(O)C(C)(C)C1=O)OC

Download SDF Download SVG Structure in 2D SDF:

FYI-1010865
FYIcenter.com

 38 38  0  0  0  0  0  0  0  0999 V2000
   25.4612    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.2488    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.0363    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.8239    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.6114    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.3990    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.1866    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9741    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9741    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7617    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5492    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.0000    4.9000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    0.7000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.5492    6.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368    7.0000    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  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
  8  7  1  0  0  0  0
  9  8  1  0  0  0  0
 10  8  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  2  0  0  0  0
 15 14  1  0  0  0  0
 16 15  1  0  0  0  0
 17 16  1  0  0  0  0
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 30 25  1  0  0  0  0
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 35 27  1  0  0  0  0
 36 24  1  0  0  0  0
 37 11  1  0  0  0  0
 38 37  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1010865-3D
FYIcenter.com

 93 93  0  0  1  0  0  0  0  0999 V2000
    3.4752    5.8860    8.9579 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9917    5.9059    9.0361 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5780    4.6800    8.3439 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0985    4.6804    8.4054 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6640    3.4461    7.7021 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1806    3.4695    7.7778 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8362    2.2644    7.0936 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3648    2.3479    7.2442 C   0  0  3  0  0  0  0  0  0  0  0  0
   11.7251    2.3530    8.7448 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1335    1.2166    6.5490 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0073    1.0452    5.0175 C   0  0  3  0  0  0  0  0  0  0  0  0
   12.3613    2.2879    4.1589 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0767    2.0566    2.6862 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2756    2.8413    1.9459 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7923    2.4678    0.5732 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2028    3.4172   -0.5514 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6398    2.8999   -1.8627 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9728    1.8716   -1.9362 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.9331    3.6861   -2.9545 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.4751    3.3107   -4.3084 C   0  0  3  0  0  0  0  0  0  0  0  0
   10.2447    4.5421   -5.1970 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2900    5.4171   -4.5839 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.0066    6.5343   -5.4175 C   0  0  0  0  0  0  0  0  0  0  0  0
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   15.6426    3.8405   -5.4685 C   0  0  3  0  0  0  0  0  0  0  0  0
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M  END
$$$$

✍: FYIcenter.com

2024-07-25, 1861👍, 0💬