Molecule FYI-1006182

A

Molecule Summary:

ID: FYI-1006182
Names:
InChIKey: NMNCPKSPLJJRSI-UHFFFAOYSA-N
SMILES: c1cc2Cc3ccc4CCc5cc6cccc7c%10cccc9c(c1)c2c8c3c4c5c(c67)c8c9%10

Received at FYIcenter.com on: 2023-11-30

Molecule ID: FYI-1006182 Edit

Molecule Structure InChIKey: NMNCPKSPLJJRSI-UHFFFAOYSA-N

Molecule Structure SMILES String: c1cc2Cc3ccc4CCc5cc6cccc7c%10cccc9c(c1)c2c8c3c4c5c(c67)c8c9%10

Download SDF Download SVG Structure in 2D SDF:

FYI-1006182
FYIcenter.com

 33 42  0  0  0  0  0  0  0  0999 V2000
    4.8499    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6374    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6374    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8499    7.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4101    4.5217    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2125    4.9001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    4.2001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.8001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    2.1001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    7.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    9.0999    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    8.3999    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    6.9999    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2125    6.2999    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8500    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6376    2.0999    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6377    0.6999    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8502    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0625    0.7001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0624    2.1001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8499    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6374    9.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2747    7.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2747    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0623    9.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2747    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  6  1  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  7  1  0  0  0  0
  2  8  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  2  0  0  0  0
 11 12  1  0  0  0  0
 12 13  2  0  0  0  0
  8 13  1  0  0  0  0
  8  9  2  0  0  0  0
  3 14  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  2  0  0  0  0
 17 18  1  0  0  0  0
 18 19  2  0  0  0  0
 14 19  1  0  0  0  0
 14 15  2  0  0  0  0
  1 20  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  2  0  0  0  0
 23 24  1  0  0  0  0
 24 25  2  0  0  0  0
 20 25  1  0  0  0  0
 20 21  2  0  0  0  0
 26 27  2  0  0  0  0
 15 27  1  0  0  0  0
  4 26  1  0  0  0  0
 28 29  1  0  0  0  0
 29 30  1  0  0  0  0
 26 30  1  0  0  0  0
  5 28  1  0  0  0  0
 31 32  1  0  0  0  0
  7 31  2  0  0  0  0
 28 32  2  0  0  0  0
 25 33  1  0  0  0  0
  7 33  1  0  0  0  0
 13 21  1  0  0  0  0
 19  9  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1006182-3D
FYIcenter.com

 51 60  0  0  0  0  0  0  0  0999 V2000
   -1.0372   -0.8635    0.2184 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3559   -0.3161    1.2937 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6048    0.6744    1.0594 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0095    1.6268    2.1399 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2036    2.4853    1.7986 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6181    3.4514    2.7175 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7468    4.2136    2.4544 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5004    3.9967    1.2904 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6941    4.8784    1.0329 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6370    4.4165   -0.0805 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0380    3.4836   -1.1030 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7724    3.2198   -2.2728 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3070    2.2881   -3.2132 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0165    2.0876   -4.4096 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5535    1.1677   -5.3417 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4000    0.4334   -5.0871 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6521    0.5963   -3.9048 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4916   -0.1625   -3.6001 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1221   -1.3352   -4.3015 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9310   -2.0075   -4.0459 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0540   -1.4822   -3.1161 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4198   -0.3784   -2.3280 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6244    0.0167   -1.2402 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6780   -0.4469   -1.0409 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1976    0.7575   -0.2123 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4007    1.4491   -0.4149 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9000    2.3158    0.5769 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0876    3.0447    0.3326 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8241    2.8219   -0.8541 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3580    1.8824   -1.8110 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1047    1.5940   -2.9834 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1294    1.2190   -1.6016 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6791    0.2411   -2.5224 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8821   -1.5301    0.3523 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6220   -0.6149    2.3004 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2120    1.0670    3.0591 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1535    2.2931    2.3113 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0500    3.6205    3.6294 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0364    4.9890    3.1612 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.2804    4.9809    1.9564 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3195    5.8796    0.7862 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.5083    3.9243    0.3704 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.0139    5.3089   -0.5970 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.7170    3.7349   -2.4199 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.9373    2.6215   -4.5911 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.0744    1.0347   -6.2852 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0581   -0.2524   -5.8518 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7937   -1.7850   -5.0287 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7050   -2.9462   -4.5402 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1288   -2.0228   -2.9253 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4672    0.1073   -1.5798 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 24  2  0  0  0  0
  1 34  1  0  0  0  0
  2  3  2  0  0  0  0
  2 35  1  0  0  0  0
  3  4  1  0  0  0  0
  3 25  1  0  0  0  0
  4  5  1  0  0  0  0
  4 36  1  0  0  0  0
  4 37  1  0  0  0  0
  5  6  1  0  0  0  0
  5 27  2  0  0  0  0
  6  7  2  0  0  0  0
  6 38  1  0  0  0  0
  7  8  1  0  0  0  0
  7 39  1  0  0  0  0
  8  9  1  0  0  0  0
  8 28  2  0  0  0  0
  9 10  1  0  0  0  0
  9 40  1  0  0  0  0
  9 41  1  0  0  0  0
 10 11  1  0  0  0  0
 10 42  1  0  0  0  0
 10 43  1  0  0  0  0
 11 12  1  0  0  0  0
 11 29  2  0  0  0  0
 12 13  2  0  0  0  0
 12 44  1  0  0  0  0
 13 14  1  0  0  0  0
 13 31  1  0  0  0  0
 14 15  2  0  0  0  0
 14 45  1  0  0  0  0
 15 16  1  0  0  0  0
 15 46  1  0  0  0  0
 16 17  2  0  0  0  0
 16 47  1  0  0  0  0
 17 18  1  0  0  0  0
 17 31  1  0  0  0  0
 18 19  1  0  0  0  0
 18 33  2  0  0  0  0
 19 20  2  0  0  0  0
 19 48  1  0  0  0  0
 20 21  1  0  0  0  0
 20 49  1  0  0  0  0
 21 22  2  0  0  0  0
 21 50  1  0  0  0  0
 22 23  1  0  0  0  0
 22 33  1  0  0  0  0
 23 24  1  0  0  0  0
 23 25  2  0  0  0  0
 24 51  1  0  0  0  0
 25 26  1  0  0  0  0
 26 27  1  0  0  0  0
 26 32  2  0  0  0  0
 27 28  1  0  0  0  0
 28 29  1  0  0  0  0
 29 30  1  0  0  0  0
 30 31  2  0  0  0  0
 30 32  1  0  0  0  0
 32 33  1  0  0  0  0
M  END
$$$$

✍: FYIcenter.com

2023-12-08, 1603👍, 0💬