Molecule FYI-1014292

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A

Molecule Summary:

ID: FYI-1014292
Names:
InChIKey: KCFCHQFZOXTLFP-RFZPGFLSSA-O
SMILES: C[C@H]1[NH2+]CC[C@H]1N

Received at FYIcenter.com on: 2025-03-25

Molecule ID: FYI-1014292 Edit

Molecule Structure InChIKey: KCFCHQFZOXTLFP-RFZPGFLSSA-O

Molecule Structure SMILES String: C[C@H]1[NH2+]CC[C@H]1N

Download SDF Download SVG Structure in 2D SDF:

FYI-1014292
FYIcenter.com

  7  7  0  0  0  0  0  0  0  0999 V2000
    2.2229    1.1326    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6555    2.4641    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.5229    3.2870    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3903    2.4641    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8229    1.1326    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.0458    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  1  1  0  0  0  0
  5  6  1  6  0  0  0
  1  7  1  6  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1014292-3D
FYIcenter.com

 20 20  0  0  1  0  0  0  0  0999 V2000
    1.0530   -0.0870    0.1014 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5636   -0.0024   -0.0083 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.0901   -1.1943   -0.7551 N   0  3  0  0  0  0  0  0  0  0  0  0
    4.4720   -0.8434   -1.2070 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5472    0.6808   -1.1456 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1324    1.1681   -0.8346 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.3891    1.4251   -2.0723 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.7577   -0.9557    0.6998 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5677   -0.1866   -0.8752 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6524    0.8080    0.5880 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0227   -0.0308    0.9881 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4851   -1.3525   -1.5718 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0611   -2.0538   -0.1852 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6003   -1.2435   -2.2146 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1746   -1.3130   -0.5163 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9586    1.1017   -2.0713 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2279    0.9795   -0.3390 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1453    2.0865   -0.2386 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6741    0.8364   -2.8565 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5796    2.3813   -2.3971 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  8  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  6  1  0  0  0  0
  2 11  1  1  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  5  1  0  0  0  0
  4 14  1  0  0  0  0
  4 15  1  0  0  0  0
  5  6  1  0  0  0  0
  5 16  1  0  0  0  0
  5 17  1  0  0  0  0
  6  7  1  0  0  0  0
  6 18  1  1  0  0  0
  7 19  1  0  0  0  0
  7 20  1  0  0  0  0
M  END
$$$$

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2025-04-11, 1040👍, 0💬