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.
YSPCTNFF, thiolacton linkage between C4 and F8
| Quorumpeps moleculeID | 83 |
| SMILES | Oc1ccc(cc1)CC(N)C(=O)NC(CO)C(=O)N2CCCC2C(=O)NC5CSC(=O)C(Cc3ccccc3)NC(=O)C(Cc4ccccc4)NC(=O)C(NC(=O)C(NC5=O)C(C)O)CC(N)=O |
| Molecular formula | C46H57N9O12S |
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