Molecule FYI-1016542

A

Molecule Summary:

ID: FYI-1016542
Names:
InChIKey: ZQUAVILLCXTKTF-UHFFFAOYSA-H
SMILES: [K+].[K+].[K+].[Bi+3].O=C([O-])CC(O)(CC(=O)[O-])C(=O)[O-].O=C([O-])CC(O)(CC(=O)[O-])C(=O)[O-]

Received at FYIcenter.com on: 2026-01-19

Molecule ID: FYI-1016542 Edit

Molecule Structure InChIKey: ZQUAVILLCXTKTF-UHFFFAOYSA-H

Molecule Structure SMILES String: [K+].[K+].[K+].[Bi+3].O=C([O-])CC(O)(CC(=O)[O-])C(=O)[O-].O=C([O-])CC(O)(CC(=O)[O-])C(=O)[O-]

Download SDF Download SVG Structure in 2D SDF:

FYI-1016542
FYIcenter.com

 30 24  0  0  0  0  0  0  0  0999 V2000
    8.4872    4.8999    0.0000 K   0  3  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 K   0  3  0  0  0  0  0  0  0  0  0  0
    4.3375    7.1372    0.0000 K   0  3  0  0  0  0  0  0  0  0  0  0
   19.5620    4.9384    0.0000 Bi  0  1  0  0  0  0  0  0  0  0  0  0
    4.3375    2.2876    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6375    3.5001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8500    4.1999    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0624    3.5001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2749    4.1999    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    6.0624    2.1000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4250    2.8001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4250    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2125    0.7000    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    3.6375    0.7000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9375    4.7124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6375    5.9247    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    1.5375    4.7124    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.4122    2.3262    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.7122    3.5386    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.9245    4.2384    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.1370    3.5386    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.3495    4.2384    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
   17.1370    2.1386    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.4996    2.8386    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4996    1.4385    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2871    0.7385    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
   14.7122    0.7385    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.0121    4.7509    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7122    5.9634    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
   12.6121    4.7509    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  8 10  2  0  0  0  0
  6 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 12 14  2  0  0  0  0
  6 15  1  0  0  0  0
 15 16  1  0  0  0  0
 15 17  2  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 21 23  2  0  0  0  0
 19 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
 25 27  2  0  0  0  0
 19 28  1  0  0  0  0
 28 29  1  0  0  0  0
 28 30  2  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1016542-3D
FYIcenter.com

 40 34  0  0  0  0  0  0  0  0999 V2000
    0.0006    0.7449   -1.1663 K   0  3  0  0  0  0  0  0  0  0  0  0
    0.1566    0.1928    2.6919 K   0  3  0  0  0  0  0  0  0  0  0  0
   -0.6648   -2.8348   -2.7323 K   0  3  0  0  0  0  0  0  0  0  0  0
   -2.7040    2.9423   -1.9193 Bi  0  1  0  0  0  0  0  0  0  0  0  0
    1.8701    3.5052    3.7565 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8538    4.2019    3.9495 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7632    5.2663    4.7682 O   0  5  0  0  0  0  0  0  0  0  0  0
    4.1723    3.8526    3.3120 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1329    3.8512    1.7474 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1360    2.9625    1.2929 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7738    5.2562    1.1753 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7441    6.3832    1.4497 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7726    6.2084    2.0789 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.4702    7.6101    0.9639 O   0  5  0  0  0  0  0  0  0  0  0  0
    5.4705    3.3948    1.1803 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6211    3.3003   -0.0279 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.5011    3.0828    1.9937 O   0  5  0  0  0  0  0  0  0  0  0  0
    2.7526   -2.8365   -4.6756 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.9626   -2.7375   -4.8433 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6320   -3.7524   -5.4248 O   0  5  0  0  0  0  0  0  0  0  0  0
    4.7086   -1.5146   -4.3789 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2089   -0.2107   -5.0700 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8212   -0.0668   -4.8426 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.9104    1.0625   -4.4899 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4248    1.1536   -4.5653 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1083    0.2647   -5.0374 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.0318    2.2545   -4.0771 O   0  5  0  0  0  0  0  0  0  0  0  0
    4.4046   -0.3020   -6.5793 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4475   -0.5294   -7.3058 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.6152   -0.1388   -7.1442 O   0  5  0  0  0  0  0  0  0  0  0  0
    4.4583    2.8399    3.6740 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9460    4.5570    3.6797 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1934    2.1206    1.8152 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7773    5.5584    1.5616 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6856    5.1719    0.0694 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.7903   -1.6745   -4.5718 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5734   -1.4278   -3.2794 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6291   -0.2459   -3.8857 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6460    1.1433   -3.4134 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4948    1.9539   -5.0073 H   0  0  0  0  0  0  0  0  0  0  0  0
  5  6  2  0  0  0  0
  6  7  1  0  0  0  0
  6  8  1  0  0  0  0
  8  9  1  0  0  0  0
  8 31  1  0  0  0  0
  8 32  1  0  0  0  0
  9 10  1  0  0  0  0
  9 11  1  0  0  0  0
  9 15  1  0  0  0  0
 10 33  1  0  0  0  0
 11 12  1  0  0  0  0
 11 34  1  0  0  0  0
 11 35  1  0  0  0  0
 12 13  2  0  0  0  0
 12 14  1  0  0  0  0
 15 16  2  0  0  0  0
 15 17  1  0  0  0  0
 18 19  2  0  0  0  0
 19 20  1  0  0  0  0
 19 21  1  0  0  0  0
 21 22  1  0  0  0  0
 21 36  1  0  0  0  0
 21 37  1  0  0  0  0
 22 23  1  0  0  0  0
 22 24  1  0  0  0  0
 22 28  1  0  0  0  0
 23 38  1  0  0  0  0
 24 25  1  0  0  0  0
 24 39  1  0  0  0  0
 24 40  1  0  0  0  0
 25 26  2  0  0  0  0
 25 27  1  0  0  0  0
 28 29  2  0  0  0  0
 28 30  1  0  0  0  0
M  END
$$$$

✍: FYIcenter.com

2026-04-13, 453👍, 0💬