Molecule FYI-1010193

A

Molecule Summary:

ID: FYI-1010193
Names:
InChIKey: MWOJOCPPUCONTI-LQXTTXHLSA-N
SMILES: C/C/3=C\\C[C@H](O)c7cc(O)cc6NC(=O)[C@](Nc1ccccc1C(=O)O)(C(=O)/C=C/C(C)=C\\C[C@H](O)c5cc(O)cc4NC(=O)[C@@](Nc2cc(O)cc(C(=O)O)c2)(C(=O)/C=C3)c45)c67

Received at FYIcenter.com on: 2024-06-02

Molecule ID: FYI-1010193 Edit

Molecule Structure InChIKey: MWOJOCPPUCONTI-LQXTTXHLSA-N

Molecule Structure SMILES String: C/C/3=C\C[C@H](O)c7cc(O)cc6NC(=O)[C@](Nc1ccccc1C(=O)O)(C(=O)/C=C/C(C)=C\C[C@H](O)c5cc(O)cc4NC(=O)[C@@](Nc2cc(O)cc(C(=O)O)c2)(C(=O)/C=C3)c45)c67

Download SDF Download SVG Structure in 2D SDF:

FYI-1010193
FYIcenter.com

 63 69  0  0  1  0  0  0  0  0999 V2000
    6.1709   10.5921    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3180    9.8731    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6236   10.4834    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9140    9.5768    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8116    8.2780    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8824    7.5028    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1825    8.0043    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2668    7.1292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0511    5.7526    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7510    5.2510    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6667    6.1261    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4994    5.3652    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3454    4.0741    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5967    3.2894    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.1878    3.4180    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1172    2.0264    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8767    1.3916    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7068    2.1486    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4662    1.5139    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2962    2.2709    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3669    3.6626    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3845    2.8767    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3001    3.7517    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5158    5.1283    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7620    5.5952    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6073    4.2973    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6780    5.6889    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9186    6.3237    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0884    5.5666    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0872    7.6802    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3759    8.4242    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6666    6.8650    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5292    7.8797    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3503    6.9358    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.4047    6.8483    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.7666    8.1009    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5071    9.2813    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8552   10.5127    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4626   10.5640    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7221    9.3836    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3741    8.1520    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6243    6.9754    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2410    7.0228    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3992    5.7744    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    3.2501    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0558    1.6362    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.8061    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9935    4.0812    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9871    2.9355    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.2539    3.9492    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.2925    6.0620    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.2094    7.3205    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0857    7.9303    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9125    9.4493    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2799   10.0395    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3713    9.4407    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3827    7.9624    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7061   10.2423    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7061   11.6358    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.9128    9.5456    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.7607   10.1218    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.5668    7.6307    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4916    7.7788    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  2  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  2  0  0  0  0
  8  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
 11  6  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 13  1  0  0  0  0
 16 15  2  0  0  0  0
 17 16  1  0  0  0  0
 18 17  2  0  0  0  0
 19 18  1  0  0  0  0
 20 19  1  0  0  0  0
 21 20  1  0  0  0  0
 22 21  2  0  0  0  0
 23 22  1  0  0  0  0
 24 23  2  0  0  0  0
 25 24  1  0  0  0  0
 26 25  2  0  0  0  0
 26 21  1  0  0  0  0
 27 26  1  0  0  0  0
 28 27  1  0  0  0  0
 29 28  2  0  0  0  0
 30 28  1  0  0  0  0
 31 30  2  0  0  0  0
 31  2  1  0  0  0  0
 27 32  1  6  0  0  0
 33 32  2  0  0  0  0
 34 32  1  0  0  0  0
 34 25  1  0  0  0  0
 35 27  1  0  0  0  0
 36 35  1  0  0  0  0
 37 36  2  0  0  0  0
 38 37  1  0  0  0  0
 39 38  2  0  0  0  0
 40 39  1  0  0  0  0
 41 40  2  0  0  0  0
 41 36  1  0  0  0  0
 42 41  1  0  0  0  0
 43 42  2  0  0  0  0
 44 42  1  0  0  0  0
 45 23  1  0  0  0  0
 20 46  1  6  0  0  0
 47 17  1  0  0  0  0
 48 12  1  0  0  0  0
 49 48  2  0  0  0  0
 50 48  1  0  0  0  0
 50 10  1  0  0  0  0
 12 51  1  6  0  0  0
 52 51  1  0  0  0  0
 53 52  2  0  0  0  0
 54 53  1  0  0  0  0
 55 54  2  0  0  0  0
 56 55  1  0  0  0  0
 57 56  2  0  0  0  0
 57 52  1  0  0  0  0
 58 56  1  0  0  0  0
 59 58  2  0  0  0  0
 60 58  1  0  0  0  0
 61 54  1  0  0  0  0
 62  8  1  0  0  0  0
  5 63  1  1  0  0  0
M  END
$$$$

Molecule Structure in 3D: Not available

✍: FYIcenter.com

2024-07-11, 472👍, 0💬