Quorumpeps Molecule
Quorumpeps®
Download optimized .hin file.
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The geometry optimization was obtained by the molecular mechanics force field method, using the Polak–Ribière conjugate gradient algorithm with a rootmean-square (RMS) gradient of 0.1 kcal/ (Å×mol) as stop criterion using the Hyperchem Professional 8.0 software (Hypercube, Gainesville, FL, USA). The structure can be rotated by dragging the structure; zooming is possible by scrolling on it.
PFTFAFF, lacton linkage between T3 and F7, modified at P1, F6, F7
| Quorumpeps moleculeID | 317 |
| SMILES | Clc1ccc(n1)C(=O)NC(C(=O)NC4C(=O)NC(C(=O)NC(C(=O)NC(c2cc(O)cc(O)c2)C(=O)NC(c3cc(O)cc(O)c3)C(=O)OC4C)C)Cc5ccccc5)Cc6ccccc6 |
| Molecular formula | C46H46ClN7O12 |
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