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.
Ac-CDFIM, thiolacton linkage between C1 and M5
| Quorumpeps moleculeID | 145 |
| SMILES | O=C(O)CC1C(=O)NC(C(=O)NC(C(=O)NC(C(=O)SCC(C(=O)N1)NC(=O)C)CCSC)C(C)CC)Cc2ccccc2 |
| Molecular formula | C29H41N5O8S2 |
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