active glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD021556 | 1.36 | 561.64 | C30H35O6N5 | C[C@@]12CC[C@@H]3c4ccc(O)cc4CC[C@H]3[C@H]1CC[C@@]2(O)C#Cc1nc2c(N)ncnc2n1[C@@H]1O[C@H](CO)[C@H](O)[C@H]1O |
|
GD019774 | 2.34 | 490.64 | C28H42O7 | C[C@H](C1CC(C)(O)C(C)(O)C(O)O1)[C@@H]1CC[C@@H]2[C@@H]3[C@@H]4O[C@H]4[C@]4(O)CC=CC(=O)[C@@]4(C)[C@H]3CC[C@@]12C |
|
GD010593 | 2.89 | 985.17 | C50H80O19 | COC1CC(OC2C(C)OC(OC3C(C)OC(OC4C(O)CC(O[C@@H]5CC[C@]6(C)C(=CC[C@]7(O)[C@H]6C[C@H](OC(C)=O)[C@]6(C)[C@](O)(C(C)=O)CC[C@]76O)C5)OC4C)CC3OC)CC2OC)OC(C)C1O |
|
GD019502 | -8.25 | 1440.59 | C57H89O21N19S2 | Cc1c(N)nc(C(CC(N)=O)NCC(N)C(N)=O)nc1C(=O)NC(C(=O)NC(C)C(O)C(C)C(=O)NC(C(=O)NCCc1nc(-c2nc(C(=O)NCCCNCCCCN)cs2)cs1)C(C)O)C(OC1OC(CO)C(O)C(O)C1OC1OC(CO)C(O)C(OC(N)=O)C1O)c1c[nH]cn1 |
|
GD018993 | 0.95 | 483.48 | C20H29O9N5 | CCCCNc1nc(NC2OCC(OC(C)=O)C(OC(C)=O)C2OC(C)=O)c(N=O)c(=O)n1C |
|
GD021785 | 1.68 | 425.49 | C22H27O4N5 | CCCNC(=O)CNc1ncnc2c1c(-c1ccccc1)cn2[C@@H]1O[C@H](C)[C@H](O)[C@H]1O |
|
GD013858 | 1.43 | 706.83 | C37H54O13 | CC(=O)OC(C)(C)CCC(=O)[C@@](C)(O)[C@@H]1[C@H](O)C[C@]2(C)[C@@H]3CC=C4C(C)=C(OC5OC(CO)C(O)C(O)C5O)C(=O)C[C@H]4[C@@]3(C)C(=O)C[C@]12C |
|
GD003021 | 1.43 | 874.95 | C43H54O12N8 | CC(=O)NC1C(OCc2ccccc2)OC(CO)C(O)C1OC(C)C(=O)NC(C)C(=O)NC(CCC(=O)NCCCCNc1c2ccccc2nc2cccc([N+](=O)[O-])c12)C(N)=O |
|
GD019730 | -4.06 | 396.39 | C16H28O11 | C=CCCC1(O)C(O)C(CO)O[C@H](O[C@@]2(CO)OC(CO)C(O)C2O)C1O |
|
GD032446 | 2.19 | 482.51 | C24H22O7N2S | CC(=O)c1c(-c2ccco2)c(C#N)c(=S)n(C2OC(CO)C(O)C(O)C2O)c1-c1ccccc1 |