Molecule FYI-1016424

A

Molecule Summary:

ID: FYI-1016424
Names:
InChIKey: CEIVJSZGYBXIDR-UQAPWSAOSA-N
SMILES: CC(=O)NC1C(O)OC(CO)C(O)C1OC(C)C(=O)N[C@H](CCC(=O)N[C@@H](CCCC[C@H](N)C(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)O)C(=O)O

Received at FYIcenter.com on: 2026-01-03

Molecule ID: FYI-1016424 Edit

Molecule Structure InChIKey: CEIVJSZGYBXIDR-UQAPWSAOSA-N

Molecule Structure SMILES String: CC(=O)NC1C(O)OC(CO)C(O)C1OC(C)C(=O)N[C@H](CCC(=O)N[C@@H](CCCC[C@H](N)C(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)O)C(=O)O

Download SDF Download SVG Structure in 2D SDF:

FYI-1016424
FYIcenter.com

 52 52  0  0  1  0  0  0  0  0999 V2000
    6.0623    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0623    7.7000    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
    7.2747    9.8000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871    7.7000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9120    7.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368    7.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368    6.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.5492    8.4000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   15.7618    7.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7618    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5492    5.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5492    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9120    2.1000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.5492    1.4000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   16.9741    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9741    9.8000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.1865    7.7000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   19.3989    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.3989    9.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.6115    7.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.6115    6.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   21.8239    8.4000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   23.0363    7.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.0363    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.2487    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.4612    7.7000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   24.2487    9.8000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    9.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9120   10.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871   10.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    8.4000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    7.7000    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    7.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    6.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    5.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    5.6000    0.0000 O   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
    3.6373    3.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    8.4000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    9.8000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373   10.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    9.8000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373   11.9000    0.0000 C   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  2  0  0  0  0
  5  3  1  0  0  0  0
  6  5  1  1  0  0  0
  7  6  1  0  0  0  0
  8  7  1  0  0  0  0
  9  8  1  0  0  0  0
 10  9  2  0  0  0  0
 11  9  1  0  0  0  0
 12 11  1  6  0  0  0
 13 12  1  0  0  0  0
 14 13  1  0  0  0  0
 15 14  1  0  0  0  0
 16 15  1  0  0  0  0
 17 16  1  0  0  0  0
 18 17  1  0  0  0  0
 19 18  2  0  0  0  0
 20 18  1  0  0  0  0
 17 21  1  6  0  0  0
 22 12  1  0  0  0  0
 23 22  2  0  0  0  0
 24 22  1  0  0  0  0
 25 24  1  1  0  0  0
 26 25  1  0  0  0  0
 27 25  1  0  0  0  0
 28 27  2  0  0  0  0
 29 27  1  0  0  0  0
 30 29  1  6  0  0  0
 31 30  1  0  0  0  0
 32 30  1  0  0  0  0
 33 32  2  0  0  0  0
 34 32  1  0  0  0  0
 35  6  1  0  0  0  0
 36 35  2  0  0  0  0
 37 35  1  0  0  0  0
 38  2  1  0  0  0  0
 39 38  1  0  0  0  0
 40 39  1  0  0  0  0
 41 40  1  0  0  0  0
 42 41  1  0  0  0  0
 43 42  1  0  0  0  0
 44 43  1  0  0  0  0
 44 39  1  0  0  0  0
 45 44  1  0  0  0  0
 46 43  1  0  0  0  0
 47 46  1  0  0  0  0
 48 41  1  0  0  0  0
 49 40  1  0  0  0  0
 50 49  1  0  0  0  0
 51 50  2  0  0  0  0
 52 50  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1016424-3D
FYIcenter.com

102102  0  0  1  0  0  0  0  0999 V2000
    4.8901  -13.7964   15.6211 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4782  -12.7529   14.7108 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9524  -12.4629   13.6394 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.6319  -12.1512   15.1785 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.2120  -11.0115   14.4396 C   0  0  3  0  0  0  0  0  0  0  0  0
    7.6536  -11.3602   12.9796 C   0  0  3  0  0  0  0  0  0  0  0  0
    7.8555  -10.1701   12.2362 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.8457  -12.1385   12.9074 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.9904  -11.6107   13.5861 C   0  0  3  0  0  0  0  0  0  0  0  0
   10.6794  -10.4760   12.7849 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0210  -10.8815   11.4613 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.6785  -11.2397   15.0504 C   0  0  3  0  0  0  0  0  0  0  0  0
   10.8490  -10.6697   15.6425 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4189  -10.3376   15.1604 C   0  0  3  0  0  0  0  0  0  0  0  0
    8.0732   -9.9318   16.5263 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.9809   -8.9768   17.1030 C   0  0  3  0  0  0  0  0  0  0  0  0
    9.1520   -7.7321   16.2103 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7891   -8.4648   18.5597 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6120   -7.6962   19.0718 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.6757   -8.8398   19.2711 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.5486   -8.4946   20.7029 C   0  0  2  0  0  0  0  0  0  0  0  0
    6.4544   -9.2927   21.4579 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4747  -10.8330   21.5090 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7385  -11.5145   22.0507 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8479  -11.1825   21.6462 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.5442  -12.5479   22.9595 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.6572  -13.3095   23.6109 C   0  0  1  0  0  0  0  0  0  0  0  0
    9.6309  -12.3584   24.3224 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9096  -11.4688   25.3346 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8734  -10.4838   25.9740 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1243   -9.5747   26.9476 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0572   -8.5949   27.6527 C   0  0  2  0  0  0  0  0  0  0  0  0
   11.0804   -9.3376   28.4162 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.2332   -7.7025   28.5968 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1025   -7.9108   29.7978 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.6509   -6.6529   27.9775 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.1672  -14.4261   24.6234 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9789  -14.5202   24.9315 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.1399  -15.2812   25.1350 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.9017  -16.3745   26.1191 C   0  0  1  0  0  0  0  0  0  0  0  0
    7.9328  -17.4332   25.5915 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2306  -17.1169   26.4699 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2570  -16.9586   25.7977 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.1790  -18.0051   27.5208 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.2652  -18.9471   27.8482 C   0  0  1  0  0  0  0  0  0  0  0  0
   12.3417  -18.3160   28.7201 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6855  -20.1575   28.5864 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7035  -20.0990   29.3198 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.3645  -21.3104   28.3914 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2491   -6.9660   20.9123 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3672   -6.5324   21.6422 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.1149   -6.1147   20.3112 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.0599  -14.2938   15.1096 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5092  -13.3262   16.5300 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6414  -14.5503   15.8683 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.7537  -12.1435   16.1852 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4038  -10.2691   14.3926 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.8809  -11.9281   12.4545 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.0207  -10.4782   11.3277 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.7166  -12.4342   13.6022 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.6132  -10.1715   13.2672 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.0607   -9.5809   12.7025 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.3133  -11.4666   11.1388 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.4753  -12.1573   15.6145 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.0210   -9.7929   15.2585 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.6044   -9.4243   14.5907 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.9459   -9.4734   17.2151 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.1950   -7.4328   15.7689 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.8379   -7.9398   15.3804 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.5704   -6.8700   16.7366 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.0909   -9.5586   18.8649 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.5162   -8.6678   21.1851 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4407   -8.9329   22.4974 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4810   -9.0000   21.0356 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.2986  -11.2289   20.5025 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6225  -11.1441   22.1234 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.6080  -12.7958   23.2647 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.1822  -13.8283   22.8001 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.1424  -11.7260   23.5882 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.4248  -12.9199   24.8271 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.4475  -12.0889   26.1115 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.1034  -10.9057   24.8507 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.3583   -9.8742   25.2018 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.6604  -11.0448   26.4899 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.5887  -10.1874   27.6864 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.3491   -9.0188   26.4018 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.5769   -7.9546   26.9315 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.5983   -9.9610   29.0678 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.5758   -8.6730   29.0333 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.8462   -6.5832   27.0229 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.1208  -15.0820   24.9590 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.5123  -15.9175   27.0361 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.3300  -17.9038   24.6847 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9537  -17.0116   25.3539 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.7756  -18.2311   26.3262 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.3493  -18.0626   28.1057 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.6954  -19.2909   26.9007 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.9306  -17.9780   29.6788 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.7976  -17.4538   28.2258 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.1353  -19.0387   28.9453 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.1265  -21.2523   27.7829 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.8579   -6.5810   19.8567 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 53  1  0  0  0  0
  1 54  1  0  0  0  0
  1 55  1  0  0  0  0
  2  3  2  0  0  0  0
  2  4  1  0  0  0  0
  4  5  1  0  0  0  0
  4 56  1  0  0  0  0
  5  6  1  0  0  0  0
  5 14  1  0  0  0  0
  5 57  1  0  0  0  0
  6  7  1  0  0  0  0
  6  8  1  0  0  0  0
  6 58  1  0  0  0  0
  7 59  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
  9 12  1  0  0  0  0
  9 60  1  0  0  0  0
 10 11  1  0  0  0  0
 10 61  1  0  0  0  0
 10 62  1  0  0  0  0
 11 63  1  0  0  0  0
 12 13  1  0  0  0  0
 12 14  1  0  0  0  0
 12 64  1  0  0  0  0
 13 65  1  0  0  0  0
 14 15  1  0  0  0  0
 14 66  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  1  0  0  0  0
 16 18  1  0  0  0  0
 16 67  1  0  0  0  0
 17 68  1  0  0  0  0
 17 69  1  0  0  0  0
 17 70  1  0  0  0  0
 18 19  2  0  0  0  0
 18 20  1  0  0  0  0
 20 71  1  0  0  0  0
 21 50  1  0  0  0  0
 21 22  1  0  0  0  0
 21 20  1  0  0  0  0
 21 72  1  1  0  0  0
 22 23  1  0  0  0  0
 22 73  1  0  0  0  0
 22 74  1  0  0  0  0
 23 24  1  0  0  0  0
 23 75  1  0  0  0  0
 23 76  1  0  0  0  0
 24 25  2  0  0  0  0
 24 26  1  0  0  0  0
 26 27  1  0  0  0  0
 26 77  1  0  0  0  0
 27 28  1  0  0  0  0
 27 37  1  0  0  0  0
 27 78  1  6  0  0  0
 28 29  1  0  0  0  0
 28 79  1  0  0  0  0
 28 80  1  0  0  0  0
 29 30  1  0  0  0  0
 29 81  1  0  0  0  0
 29 82  1  0  0  0  0
 30 31  1  0  0  0  0
 30 83  1  0  0  0  0
 30 84  1  0  0  0  0
 31 85  1  0  0  0  0
 31 86  1  0  0  0  0
 32 34  1  0  0  0  0
 32 33  1  0  0  0  0
 32 31  1  0  0  0  0
 32 87  1  6  0  0  0
 33 88  1  0  0  0  0
 33 89  1  0  0  0  0
 34 35  2  0  0  0  0
 34 36  1  0  0  0  0
 36 90  1  0  0  0  0
 37 38  2  0  0  0  0
 37 39  1  0  0  0  0
 39 40  1  0  0  0  0
 39 91  1  0  0  0  0
 40 41  1  0  0  0  0
 40 42  1  0  0  0  0
 40 92  1  1  0  0  0
 41 93  1  0  0  0  0
 41 94  1  0  0  0  0
 41 95  1  0  0  0  0
 42 43  2  0  0  0  0
 42 44  1  0  0  0  0
 44 45  1  0  0  0  0
 44 96  1  0  0  0  0
 45 46  1  0  0  0  0
 45 47  1  0  0  0  0
 45 97  1  6  0  0  0
 46 98  1  0  0  0  0
 46 99  1  0  0  0  0
 46100  1  0  0  0  0
 47 48  2  0  0  0  0
 47 49  1  0  0  0  0
 49101  1  0  0  0  0
 50 51  2  0  0  0  0
 50 52  1  0  0  0  0
 52102  1  0  0  0  0
M  END
$$$$

✍: FYIcenter.com

2026-01-24, 118👍, 0💬