natural glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD119582 | 11.49 | 801.25 | C50H88O7 | CCCCCCCCCCCCCCCC(=O)OCC1OC(OC2CCC3(C)C(=CCC4C3CCC3(C)C(C(C)CCC(C)C(C)C)CCC43)C2)C(O)C(O)C1O |
|
GD119583 | 0.99 | 380.35 | C18H20O9 | CC(=O)OC1COC(OC(=O)c2ccccc2)C(OC(C)=O)C1OC(C)=O |
|
GD119584 | -0.88 | 496.42 | C22H24O13 | COc1c(O)cc(C2Oc3cc(O)cc(O)c3CC2O)cc1OC1OC(C(=O)O)C(O)C(O)C1O |
|
GD119585 | -0.08 | 985.13 | C49H76O20 | CCOC(=O)C1OC(OC2CCC3(C)C(CCC4(C)C3CC=C3C5CC(C)(C)CC(C(=O)O)C5C(O)CC34C)C2(C)C=O)C(OC2OC(CO)C(O)C(O)C2O)C(OC2OCC(O)C(O)C2O)C1O |
|
GD119586 | 4.04 | 1005.21 | C53H80O18 | CC=C(C)C(=O)OC1C(OC(=O)C(C)=CC)C2(COC(C)=O)C(O)CC3(C)C(=CCC4C5(C)CCC(OC6OC(C(=O)O)C(O)C(OC7OCC(O)C(O)C7O)C6O)C(C)(C)C5CCC43C)C2CC1(C)C |
|
GD119587 | -2.11 | 654.57 | C29H34O17 | COc1ccc(-c2coc3cc(OC4OC(COC5OC(CO)C(O)C(O)C5O)C(O)C(O)C4O)c(OC)c(O)c3c2=O)cc1O |
|
GD119588 | -2.0 | 531.3 | C15H23O14N3P2 | CC1OC(OP(=O)(O)OP(=O)(O)OCC2OC(n3ccc(=N)nc3O)C(O)C2O)C(O)CC1=O |
|
GD119589 | -0.36 | 417.46 | C21H27O6N3 | CN(CCc1nc[nH]c1C1OC(CO)C(O)C(O)C1O)C(=O)C=Cc1ccccc1 |
|
GD119590 | 3.13 | 1112.38 | C60H85O13N7 | CC1(CO)CCC2(C(=O)O)C(C1)C1=CC3C#CC4CCCC45C(O)=NC(C(c4cnc[nH]4)C(O)CC(N)O)C5CC4C(O)C(OC5OCC(O)C(O)C5O)C(C)(CO)C5CCC6(C)C1(CCCC36C45C)C1Cc3nc[nH]c3NCC12 |
|
GD119591 | -0.58 | 517.49 | C25H27O11N | COC(=O)C1Cc2cc(O)c(OC3OC(CO)C(O)C(O)C3O)cc2N1C(=O)C=Cc1ccc(O)cc1 |