Molecule Editor

Molecule ID: FYI-1016156 Edit

Molecule Structure InChIKey: ASCFNMCAHFUBCO-UHFFFAOYSA-M

Molecule Structure SMILES String: O=C([O-])COP(=O)(O)O

Download SDF Download SVG Structure in 2D SDF:

FYI-1016156
FYIcenter.com

  9  8  0  0  0  0  0  0  0  0999 V2000
    4.8498    1.2124    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
    4.1498    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    0.5124    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5498    2.4248    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6374    1.9124    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4250    1.2124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    1.9124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    3.3124    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    1.2124    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
  4  1  1  0  0  0  0
  5  1  1  0  0  0  0
  6  5  1  0  0  0  0
  7  6  1  0  0  0  0
  8  7  2  0  0  0  0
  9  7  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1016156-3D
FYIcenter.com

 13 12  0     0  0  0  0  0  0999 V2000
    1.7272   -0.0540   -0.1084 P   0  0  0  0  0  0  0  0  0  0  0  0
    0.1465   -0.2813   -0.3750 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9159   -0.4562    1.4466 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8632    1.5573   -0.0949 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.6397   -0.7592   -1.0688 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4171   -1.2696    0.0010 O   0  5  0  0  0  0  0  0  0  0  0  0
   -2.9177    0.9417   -0.3025 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7824    0.3509    0.4887 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1752   -0.0296    0.0134 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6442   -0.0009    1.5156 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6443    1.4360    0.4576 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8194   -0.4639    1.8285 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7569    1.9576   -0.0393 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  1  5  2  0  0  0  0
  2  8  1  0  0  0  0
  3 12  1  0  0  0  0
  4 13  1  0  0  0  0
  6  9  1  0  0  0  0
  7  9  2  0  0  0  0
  8  9  1  0  0  0  0
  8 10  1  0  0  0  0
  8 11  1  0  0  0  0
M  END
$$$$