Molecule FYI-1016324

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A

Molecule Summary:

ID: FYI-1016324
Names:
InChIKey: NUUPJBRGQCEZSI-RFZPGFLSSA-N
SMILES: O[C@@H]1CC[C@@H](O)C1

Received at FYIcenter.com on: 2025-12-06

Molecule ID: FYI-1016324 Edit

Molecule Structure InChIKey: NUUPJBRGQCEZSI-RFZPGFLSSA-N

Molecule Structure SMILES String: O[C@@H]1CC[C@@H](O)C1

Download SDF Download SVG Structure in 2D SDF:

FYI-1016324
FYIcenter.com

  7  7  0  0  1  0  0  0  0  0999 V2000
    2.7282    2.3834    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3589    2.0923    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4915    0.1306    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4283    1.1710    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8206    1.0247    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 O   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
  5  1  1  0  0  0  0
  5  6  1  1  0  0  0
  3  7  1  6  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1016324-3D
FYIcenter.com

 17 17  0     1  0  0  0  0  0999 V2000
   -1.9791    0.4446    0.6957 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3261    0.2795   -0.1035 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2111    0.2704   -0.4886 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.0187    0.2463    0.4484 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.0623    1.0977   -0.3928 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6884   -1.1555   -0.5764 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4715   -1.1829    0.4173 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8299    0.5406   -1.3492 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0749    0.6076    1.4811 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4809    1.2720   -1.3913 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1039    2.0720    0.0785 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3148   -1.3617   -1.5862 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4454   -1.9025   -0.3190 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0856   -1.4457    1.4097 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2212   -1.9306    0.1397 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2484    1.3782    0.7341 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6176    1.2072   -0.1053 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  3  1  0  0  0  0
  1 16  1  0  0  0  0
  2  4  1  0  0  0  0
  2 17  1  0  0  0  0
  3  5  1  0  0  0  0
  3  6  1  0  0  0  0
  3  8  1  0  0  0  0
  4  5  1  0  0  0  0
  4  7  1  0  0  0  0
  4  9  1  0  0  0  0
  5 10  1  0  0  0  0
  5 11  1  0  0  0  0
  6  7  1  0  0  0  0
  6 12  1  0  0  0  0
  6 13  1  0  0  0  0
  7 14  1  0  0  0  0
  7 15  1  0  0  0  0
M  END
$$$$

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2025-12-09, 753👍, 0💬