Molecule FYI-1016145

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Molecule Summary:

ID: FYI-1016145
Names:
InChIKey: QKEWQOJCHPFEAF-YFKPBYRVSA-M
SMILES: NCCC[C@H](N)CC(=O)[O-]

Received at FYIcenter.com on: 2025-11-28

Molecule ID: FYI-1016145 Edit

Molecule Structure InChIKey: QKEWQOJCHPFEAF-YFKPBYRVSA-M

Molecule Structure SMILES String: NCCC[C@H](N)CC(=O)[O-]

Download SDF Download SVG Structure in 2D SDF:

FYI-1016145
FYIcenter.com

 10  9  0  0  1  0  0  0  0  0999 V2000
    4.8497    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0621    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2747    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871    2.1000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2747    0.0000    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    3.6373    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    1.4000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  1  0  0  0
  3  2  1  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  2  1  0  0  0  0
  8  7  1  0  0  0  0
  9  8  1  0  0  0  0
 10  9  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1016145-3D
FYIcenter.com

 23 22  0     1  0  0  0  0  0999 V2000
    2.3221   -0.7385    1.1606 O   0  5  0  0  0  0  0  0  0  0  0  0
    2.0184   -1.8711   -0.7995 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2425    2.5485   -0.5668 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6919   -1.1002   -0.4685 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.6596    1.3754    0.2073 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.5720    0.7001    0.8435 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5977    0.1315   -0.1485 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4108    0.4040   -0.7156 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7593   -0.5918    0.5321 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9676   -0.8579   -0.0446 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3249    1.7128    1.0109 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2423   -0.1062    1.5098 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0794    1.4270    1.4921 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9905    0.9447   -0.7714 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1096   -0.5804   -0.8234 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2853    0.9214   -1.1351 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7964    0.1194   -1.5782 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2858    0.0915    1.2071 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3828   -1.4287    1.1296 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0644    3.0242   -0.9368 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2240    3.2150    0.0471 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4856   -1.5348    0.0002 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0703   -0.3243   -1.0106 H   0  0  0  0  0  0  0  0  0  0  0  0
  1 10  1  0  0  0  0
  2 10  2  0  0  0  0
  3  5  1  0  0  0  0
  3 20  1  0  0  0  0
  3 21  1  0  0  0  0
  4  9  1  0  0  0  0
  4 22  1  0  0  0  0
  4 23  1  0  0  0  0
  5  6  1  0  0  0  0
  5  8  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  9  1  0  0  0  0
  7 14  1  0  0  0  0
  7 15  1  0  0  0  0
  8 10  1  0  0  0  0
  8 16  1  0  0  0  0
  8 17  1  0  0  0  0
  9 18  1  0  0  0  0
  9 19  1  0  0  0  0
M  END
$$$$

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