Molecule FYI-1016534

A

Molecule Summary:

ID: FYI-1016534
Names:
InChIKey: UHAVFJCNTPHPKH-BJDJZHNGSA-N
SMILES: N=C(N)NCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CS)NC(=O)[C@@H](N)CC(N)=O)C(=O)O

Received at FYIcenter.com on: 2026-01-19

Molecule ID: FYI-1016534 Edit

Molecule Structure InChIKey: UHAVFJCNTPHPKH-BJDJZHNGSA-N

Molecule Structure SMILES String: N=C(N)NCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CS)NC(=O)[C@@H](N)CC(N)=O)C(=O)O

Download SDF Download SVG Structure in 2D SDF:

FYI-1016534
FYIcenter.com

 33 33  0  0  1  0  0  0  0  0999 V2000
    7.1878    9.3089    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.5192    9.7415    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.8104   11.1110    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7699   12.0477    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0609   13.4171    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.4385   11.6151    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.5597    8.8048    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    8.4871    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    0.0000    2.1000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  1  0  0  0
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 22 17  1  0  0  0  0
 18 23  1  1  0  0  0
 24 23  2  0  0  0  0
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 26 25  1  6  0  0  0
 27 32  1  0  0  0  0
 28 26  1  0  0  0  0
 29 28  1  0  0  0  0
 30 29  1  0  0  0  0
 31 30  1  0  0  0  0
 32 31  1  0  0  0  0
 33 32  2  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1016534-3D
FYIcenter.com

 65 65  0  0  1  0  0  0  0  0999 V2000
    6.9867    2.3279   -4.0925 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.0600    2.8757   -5.2471 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0099    3.7683   -5.5892 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.2001    2.6616   -6.2685 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.1444    1.6667   -6.1952 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6862    0.2821   -6.5511 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5883   -0.7697   -6.5764 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0245   -2.1725   -7.0270 C   0  0  2  0  0  0  0  0  0  0  0  0
    5.7320   -3.0477   -6.0603 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.0138   -3.2241   -5.6227 C   0  0  0  0  0  0  0  0  0  0  0  0
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    9.6656   -0.5879   -4.7817 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4612   -1.3477   -4.4248 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.4908   -1.8391   -3.1036 C   0  0  0  0  0  0  0  0  0  0  0  0
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    7.3052   -2.6640   -2.5717 C   0  0  2  0  0  0  0  0  0  0  0  0
    6.5094   -1.8254   -1.5566 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8487   -2.5484   -1.2658 S   0  0  0  0  0  0  0  0  0  0  0  0
    7.7456   -4.0032   -2.1152 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.4503   -4.2151   -0.9451 C   0  0  0  0  0  0  0  0  0  0  0  0
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 31 33  1  0  0  0  0
 33 65  1  0  0  0  0
M  END
$$$$

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2026-04-13, 476👍, 0💬