Molecule FYI-1014970

Home > Molecule

A

Molecule Summary:

ID: FYI-1014970
Names:
InChIKey: ZFPGARUNNKGOBB-UHFFFAOYSA-N
SMILES: CCN1CCCC1=O

Received at FYIcenter.com on: 2025-06-10

Molecule ID: FYI-1014970 Edit

Molecule Structure InChIKey: ZFPGARUNNKGOBB-UHFFFAOYSA-N

Molecule Structure SMILES String: CCN1CCCC1=O

Download SDF Download SVG Structure in 2D SDF:

FYI-1014970
FYIcenter.com

  8  8  0  0  0  0  0  0  0  0999 V2000
    4.6407    2.3292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4282    3.0292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2158    2.3292    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.9369    2.8986    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    1.8582    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7000    0.6458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0695    0.9369    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1098    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
  6  5  1  0  0  0  0
  7  6  1  0  0  0  0
  7  3  1  0  0  0  0
  8  7  2  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1014970-3D
FYIcenter.com

 19 19  0     0  0  0  0  0  0999 V2000
   -0.1669   -2.0525    0.1048 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3261    0.2439    0.2641 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3616    1.4862    0.0034 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8231    1.0896    0.0631 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8280   -0.3614   -0.4033 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4740   -0.8722    0.0311 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7343    0.2118    0.5946 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5932    0.2546   -0.6579 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0766    1.8406   -0.9924 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1078    2.2379    0.7561 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4646    1.7353   -0.5430 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1788    1.1394    1.1000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8968   -0.4312   -1.4933 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6324   -0.9359    0.0623 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9636    1.0504    1.2598 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9399   -0.7194    1.1337 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3657   -0.5869   -1.3207 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4238    1.1783   -1.2209 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6539    0.2058   -0.3935 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  6  2  0  0  0  0
  2  3  1  0  0  0  0
  2  6  1  0  0  0  0
  2  7  1  0  0  0  0
  3  4  1  0  0  0  0
  3  9  1  0  0  0  0
  3 10  1  0  0  0  0
  4  5  1  0  0  0  0
  4 11  1  0  0  0  0
  4 12  1  0  0  0  0
  5  6  1  0  0  0  0
  5 13  1  0  0  0  0
  5 14  1  0  0  0  0
  7  8  1  0  0  0  0
  7 15  1  0  0  0  0
  7 16  1  0  0  0  0
  8 17  1  0  0  0  0
  8 18  1  0  0  0  0
  8 19  1  0  0  0  0
M  END
$$$$

✍: FYIcenter.com

2025-06-18, 546👍, 0💬