active glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD002650 | 1.09 | 863.92 | C42H53O13N7 | CC(=O)NC1C(OCc2ccccc2)OC(CO)C(O)C1OC(C)C(=O)N[C@H](C)C(=O)N[C@H](CCC(=O)OCCCNC1c2ccccc2Nc2cccc([N+](=O)[O-])c21)C(N)=O |
|
GD000012 | 3.16 | 811.88 | C42H53O15N | CC[C@]1(O)C[C@H](OC2CC(N(C)C)C(OC3CC(O)C(OC4CCC(=O)C(C)O4)C(C)O3)C(C)O2)c2c(cc3c(c2O)C(=O)c2c(O)cccc2C3=O)[C@H]1C(=O)OC |
|
GD019765 | 2.98 | 504.62 | C28H40O8 | COC1CC(O[C@@H]2CC[C@]3(C)C(=CC[C@]4(O)C3CCC35C(=O)O[C@]6(C)O[C@@]34CC[C@H]56)C2)OC(C)C1O |
|
GD007019 | -0.55 | 512.6 | C26H40O10 | C[C@]1(C(=O)OC2OC(CO)C(O)C(O)C2O)CCC[C@]2(C)[C@@H]3C4CC5CC3(CC[C@H]12)[C@H](O)[C@@]5(CO)O4 |
|
GD017303 | -0.17 | 460.44 | C23H24O10 | O=C1C=C(c2ccc(O)cc2)[C@H](OC2OC(CO)C(O)C(O)C2O)Cc2ccc(O)cc2O1 |
|
GD021277 | 4.59 | 852.07 | C45H73O14N | CC=CC1O[C@](O)([C@H](C)[C@H](O)[C@H](C)C2OC(=O)C(OC)=CC(C)=C[C@H](C)[C@H](O)[C@H](C)[C@H](O)[C@H](C)CC(C)=CC=C[C@H]2OC)C[C@H](OC2CC(O)C(OC(N)=O)C(C)O2)[C@H]1C |
|
GD020261 | 3.76 | 1111.01 | C51H64O16N7Br | COC(=O)CC[C@H](NC(=O)[C@H](C)NC(=O)COC1C(O)C(COC(=O)CCCCCCCCCCNC(=O)c2ccc([N+](=O)[O-])c3[nH]c4cc(Br)ccc4c(=O)c23)OC(OCc2ccccc2)C1NC(C)=O)C(N)=O |
|
GD021608 | 2.14 | 600.55 | C30H29O12F | CC(=O)OC1C(C)OC(O[C@@H]2C[C@](O)(C(C)=O)Cc3c(O)c4c(c(O)c32)C(=O)c2ccccc2C4=O)C(F)C1OC(C)=O |
|
GD000745 | 1.48 | 877.95 | C43H55O13N7 | CCC(COC(=O)CC[C@H](NC(=O)[C@H](C)NC(=O)C(C)OC1C(O)C(CO)OC(OCc2ccccc2)C1NC(C)=O)C(N)=O)NC1c2ccccc2Nc2cccc([N+](=O)[O-])c21 |
|
GD016594 | 2.78 | 727.78 | C37H41O9N7 | CC[C@@]12C=CCN3CC[C@@]4(C(=C(C(=O)OC)[C@H]1Nc1ncnc5c1ncn5C1OC(COC(C)=O)C(OC(C)=O)C1OC(C)=O)Nc1ccccc14)C32 |