Molecule FYI-1014882

A

Molecule Summary:

ID: FYI-1014882
Names:
InChIKey: GNMSIOVFIIOAPC-CICLJIOASA-N
SMILES: CC1=CC(=O)[C@@H](O)[C@@]4(C)[C@H]1C[C@@]3(O)O[C@H]2C(=O)O[C@@H]5[C@H](C)[C@@]2(O)[C@@]3(C)[C@@H]4[C@H]5O

Received at FYIcenter.com on: 2025-06-04

Molecule ID: FYI-1014882 Edit

Molecule Structure InChIKey: GNMSIOVFIIOAPC-CICLJIOASA-N

Molecule Structure SMILES String: CC1=CC(=O)[C@@H](O)[C@@]4(C)[C@H]1C[C@@]3(O)O[C@H]2C(=O)O[C@@H]5[C@H](C)[C@@]2(O)[C@@]3(C)[C@@H]4[C@H]5O

Download SDF Download SVG Structure in 2D SDF:

FYI-1014882
FYIcenter.com

 28 32  0  0  1  0  0  0  0  0999 V2000
    0.0000    5.4798    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2271    6.0261    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3674    7.3620    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5946    7.9084    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7350    9.2443    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6813    7.1188    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5410    5.7828    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3138    5.2365    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1734    3.9007    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2601    3.1111    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0968    2.4395    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4006    1.7752    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.7144    1.4960    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3860    2.6592    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4873    3.6574    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6276    4.9934    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9646    5.3607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2741    6.6678    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.9629    4.4619    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6495    3.1391    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9678    2.4282    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5820    2.0839    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7558    1.2605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2201    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.7647    4.0726    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2496    1.7034    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.7680    6.3293    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9085    7.6651    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  2  0  0  0  0
  6  4  1  0  0  0  0
  7  6  1  0  0  0  0
  8  7  1  0  0  0  0
  8  2  1  0  0  0  0
  8  9  1  1  0  0  0
 10  9  1  0  0  0  0
 10 11  1  1  0  0  0
 12 10  1  0  0  0  0
 13 12  1  6  0  0  0
 14 13  1  0  0  0  0
 15 14  1  0  0  0  0
 15 10  1  0  0  0  0
 16 15  1  0  0  0  0
 16  7  1  0  0  0  0
 16 17  1  1  0  0  0
 17 18  1  1  0  0  0
 19 17  1  0  0  0  0
 20 19  1  0  0  0  0
 20 14  1  0  0  0  0
 20 21  1  6  0  0  0
 19 22  1  6  0  0  0
 23 22  1  0  0  0  0
 23 13  1  0  0  0  0
 24 23  2  0  0  0  0
 15 25  1  1  0  0  0
 14 26  1  1  0  0  0
  7 27  1  1  0  0  0
  6 28  1  1  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1014882-3D
FYIcenter.com

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