Molecule Editor

Molecule ID: FYI-1016232 Edit

Molecule Structure InChIKey: UHXXJVYBIFPFFQ-DKWTVANSSA-N

Molecule Structure SMILES String: N[C@@H](CS)C(=O)O.[Zn]

Download SDF Download SVG Structure in 2D SDF:

FYI-1016232
FYIcenter.com

  8  6  0  0  1  0  0  0  0  0999 V2000
    0.0000    1.7998    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.3155    2.2786    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3880    1.3787    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1449    0.0000    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.5587    3.6574    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8742    4.1363    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4862    4.5573    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.3942    2.5440    0.0000 Zn  0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  6  0  0  0
  3  2  1  0  0  0  0
  4  3  1  0  0  0  0
  5  2  1  0  0  0  0
  6  5  2  0  0  0  0
  7  5  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1016232-3D
FYIcenter.com

 15 13  0  0  1  0  0  0  0  0999 V2000
    1.0606    0.0600    0.2181 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.6400    0.0837    0.2770 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.1832   -0.1746    1.6837 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4386    1.0122    2.8419 S   0  0  0  0  0  0  0  0  0  0  0  0
    3.0904   -0.9254   -0.7782 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2658   -1.2102   -1.6697 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.3200   -1.4105   -0.7603 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3462   -0.5341   -1.7523 Zn  0  0  0  0  0  0  0  0  0  0  0  0
    0.8383    0.9216    0.7834 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8363   -0.6171    0.9924 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9443    1.0746   -0.0838 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2711   -0.0676    1.7175 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9341   -1.1893    2.0146 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2614    2.0483    2.5943 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9771   -1.1495   -0.0756 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  9  1  0  0  0  0
  1 10  1  0  0  0  0
  2  3  1  0  0  0  0
  2  5  1  0  0  0  0
  2 11  1  6  0  0  0
  3  4  1  0  0  0  0
  3 12  1  0  0  0  0
  3 13  1  0  0  0  0
  4 14  1  0  0  0  0
  5  6  2  0  0  0  0
  5  7  1  0  0  0  0
  7 15  1  0  0  0  0
M  END
$$$$