仅限演示使用:下面结果随机从前50个优化分子中选取。
For DEMO Purpose: The following results are randomly selected from the Top 50 optimization results.
O=C(O)C1=CO[C@@H](O[C@@H]2O[C@H](COC(=O)C3=CO[C@@H](O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H]4C(CO)=C[C@H](O)[C@H]34)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2C(CO)=C[C@H](O)[C@H]12
Optimized 10
![CC[C@H]1CC(C(=O)OC[C@@H]2O[C@@H](CC(=O)N3C[C@H](O)[C@@H](O[C@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]4O)[C@@H]3CO)[C@@H]([C@@H]3C[C@H]3C)[C@@H]2O)=C[C@H]1C(=O)O](/api/molecule.svg?smiles=CC%5BC%40H%5D1CC%28C%28%3DO%29OC%5BC%40%40H%5D2O%5BC%40%40H%5D%28CC%28%3DO%29N3C%5BC%40H%5D%28O%29%5BC%40%40H%5D%28O%5BC%40H%5D4O%5BC%40H%5D%28CO%29%5BC%40%40H%5D%28O%29%5BC%40H%5D%28O%29%5BC%40%40H%5D4O%29%5BC%40%40H%5D3CO%29%5BC%40%40H%5D%28%5BC%40%40H%5D3C%5BC%40H%5D3C%29%5BC%40%40H%5D2O%29%3DC%5BC%40H%5D1C%28%3DO%29O&width=400&height=250)
C31H47NO15
![CC(=O)O[C@@H]1[C@@H](OC(=O)c2ccc(C3=C[C@@H]4[C@H](CCCC4(C)C)C(C(=O)O)=C3)cc2)OC(C[C@@H]2OC(CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O](/api/molecule.svg?smiles=CC%28%3DO%29O%5BC%40%40H%5D1%5BC%40%40H%5D%28OC%28%3DO%29c2ccc%28C3%3DC%5BC%40%40H%5D4%5BC%40H%5D%28CCCC4%28C%29C%29C%28C%28%3DO%29O%29%3DC3%29cc2%29OC%28C%5BC%40%40H%5D2OC%28CO%29%5BC%40%40H%5D%28O%29%5BC%40H%5D%28O%29%5BC%40H%5D2O%29%5BC%40H%5D%28O%29%5BC%40H%5D1O&width=400&height=250)
C34H44O14
![O=C(N[C@@H]1[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)C[C@@H](c2ccccc2)NC(=O)[C@@H]1O)C1=CO[C@H]2C[C@H](O)c3ccccc3[C@@H]12](/api/molecule.svg?smiles=O%3DC%28N%5BC%40%40H%5D1%5BC%40%40H%5D%28O%5BC%40%40H%5D2O%5BC%40H%5D%28CO%29%5BC%40%40H%5D%28O%29%5BC%40H%5D%28O%29%5BC%40%40H%5D2O%29C%5BC%40%40H%5D%28c2ccccc2%29NC%28%3DO%29%5BC%40%40H%5D1O%29C1%3DCO%5BC%40H%5D2C%5BC%40H%5D%28O%29c3ccccc3%5BC%40%40H%5D12&width=400&height=250)
C31H36N2O11
![C[C@@H]1C=CN=C(C(=O)OC[C@@H](O)C=C2O[C@@H]3C[C@H](c4ccccc4)O[C@H](CO)[C@H]3[C@H]2CO)CC1O[C@@H]1O[C@H](C(=O)O)[C@@H](O)[C@@H]1O](/api/molecule.svg?smiles=C%5BC%40%40H%5D1C%3DCN%3DC%28C%28%3DO%29OC%5BC%40%40H%5D%28O%29C%3DC2O%5BC%40%40H%5D3C%5BC%40H%5D%28c4ccccc4%29O%5BC%40H%5D%28CO%29%5BC%40H%5D3%5BC%40H%5D2CO%29CC1O%5BC%40%40H%5D1O%5BC%40H%5D%28C%28%3DO%29O%29%5BC%40%40H%5D%28O%29%5BC%40%40H%5D1O&width=400&height=250)
C31H39NO13
![CN(C(=O)[C@@H]1O[C@H](CO)C[C@H]1CO[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]1OCOCON)C1C(=O)C[C@H]1c1ccc(CO)cc1](/api/molecule.svg?smiles=CN%28C%28%3DO%29%5BC%40%40H%5D1O%5BC%40H%5D%28CO%29C%5BC%40H%5D1CO%5BC%40H%5D1O%5BC%40H%5D%28CO%29%5BC%40%40H%5D%28O%29%5BC%40H%5D%28O%29%5BC%40%40H%5D1OCOCON%29C1C%28%3DO%29C%5BC%40H%5D1c1ccc%28CO%29cc1&width=400&height=250)
C27H40N2O13
![O=C(O)[C@@H]1O[C@H](Oc2occc(=O)c2C(O)=C[C@H]2[CH]CO[C@@H]2c2ccc(O[C@@H]3[CH][C@H](O)[C@@H](O)[C@H](CO)O3)cc2O)[CH][C@H](O)[C@H]1O](/api/molecule.svg?smiles=O%3DC%28O%29%5BC%40%40H%5D1O%5BC%40H%5D%28Oc2occc%28%3DO%29c2C%28O%29%3DC%5BC%40H%5D2%5BCH%5DCO%5BC%40%40H%5D2c2ccc%28O%5BC%40%40H%5D3%5BCH%5D%5BC%40H%5D%28O%29%5BC%40%40H%5D%28O%29%5BC%40H%5D%28CO%29O3%29cc2O%29%5BCH%5D%5BC%40H%5D%28O%29%5BC%40H%5D1O&width=400&height=250)
C29H31O16
![C=C(O)C(O)=NC(C(=O)OC1OC(COC(=O)c2ccccc2CO)C(C(=O)O)C(C(=O)O)C1CO)=C1CC(O)C1O](/api/molecule.svg?smiles=C%3DC%28O%29C%28O%29%3DNC%28C%28%3DO%29OC1OC%28COC%28%3DO%29c2ccccc2CO%29C%28C%28%3DO%29O%29C%28C%28%3DO%29O%29C1CO%29%3DC1CC%28O%29C1O&width=400&height=250)
C26H29NO15
![O=C(N[C@H]1C[C@H](O)[C@H]2[CH]C=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)[C@H]2C1)OCC[C@@H]1CCN(C(=O)C2(C(=O)O)C[C@H]2O)C1](/api/molecule.svg?smiles=O%3DC%28N%5BC%40H%5D1C%5BC%40H%5D%28O%29%5BC%40H%5D2%5BCH%5DC%3DC%28O%5BC%40%40H%5D3O%5BC%40H%5D%28CO%29%5BC%40%40H%5D%28O%29%5BC%40H%5D3O%29%5BC%40H%5D2C1%29OCC%5BC%40%40H%5D1CCN%28C%28%3DO%29C2%28C%28%3DO%29O%29C%5BC%40H%5D2O%29C1&width=400&height=250)
C26H37N2O12
![C=Cc1ccc2c(c1)=C(C)[C@@H](O)[C@H](C(=O)N1C[C@H](O)[C@H](O[C@@H]3C=C(C(=O)O)[C@H]4O[C@@H](C(C)C)[C@H](O)[C@H](O)[C@@H]43)C1)[C@H](O)C=2](/api/molecule.svg?smiles=C%3DCc1ccc2c%28c1%29%3DC%28C%29%5BC%40%40H%5D%28O%29%5BC%40H%5D%28C%28%3DO%29N1C%5BC%40H%5D%28O%29%5BC%40H%5D%28O%5BC%40%40H%5D3C%3DC%28C%28%3DO%29O%29%5BC%40H%5D4O%5BC%40%40H%5D%28C%28C%29C%29%5BC%40H%5D%28O%29%5BC%40H%5D%28O%29%5BC%40%40H%5D43%29C1%29%5BC%40H%5D%28O%29C%3D2&width=400&height=250)
C31H39NO10
![O=C(O[C@@H]1C2=COC=C(C=C(O)O)C2C1CO)c1ccc(C2O[C@@H](OC3=c4c(C(O)C(=O)O)cc(=O)oc4=C3)[C@@H](O)[C@H](O)[C@H]2O)cc1](/api/molecule.svg?smiles=O%3DC%28O%5BC%40%40H%5D1C2%3DCOC%3DC%28C%3DC%28O%29O%29C2C1CO%29c1ccc%28C2O%5BC%40%40H%5D%28OC3%3Dc4c%28C%28O%29C%28%3DO%29O%29cc%28%3DO%29oc4%3DC3%29%5BC%40%40H%5D%28O%29%5BC%40H%5D%28O%29%5BC%40H%5D2O%29cc1&width=400&height=250)
C31H28O16
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