natural glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD119842 | 0.44 | 798.96 | C41H66O15 | CC1(C)CCC2(C(=O)O)C(OC3OC(CO)C(O)C(O)C3OC3OCC(O)C(O)C3O)CC3(C)C(=CCC4C5(C)CC(O)C(O)C(C)(CO)C5CCC43C)C2C1 |
|
GD119843 | -0.21 | 477.97 | C20H28O7N3ClS | O=S(=O)(NCC1OC(CC(O)=NCCN2CCOCC2)C(O)C1O)c1ccc(Cl)cc1 |
|
GD119844 | 2.27 | 704.85 | C38H56O12 | CC(=O)OC(C)(C)C=CC(=O)C(C)(O)C1C(O)CC2(C)C3CC=C4C(C=C(OC5OC(CO)C(O)C(O)C5O)C(=O)C4(C)C)C3(C)CCC12C |
|
GD119845 | -2.14 | 872.91 | C41H60O20 | CCCCCC=CC=CC(O)CC=CC=CC(=O)OC1C(O)C(c2c(O)cc(O)cc2CO)OC(CO)C1OC1OC(CO)C(O)C(O)C1OC1OC(CO)C(O)C(O)C1O |
|
GD119846 | 2.31 | 906.09 | C29H39O17N7P3ClS | CC(C)(COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O)C(O)C(O)=NCCC(O)=NCCSC(=O)c1ccc(Cl)cc1 |
|
GD119847 | -3.21 | 409.4 | C17H23O7N5 | N=C1N=C(O)C2C(CNC3C=CC(O)C3O)=CN(C3OC(CO)C(O)C3O)C2=N1 |
|
GD119848 | 6.82 | 1088.52 | C53H76O17ClBr | CCc1c(Br)c(O)c(Cl)c(O)c1C(=O)OC1C(C)OC(OCC2=CC=CCC(O)C(C)=CC(CC)C(OC3OC(C)(C)C(OCC(C)C)C(O)C3O)C(C)=CC(C)=CCC(C(C)O)OC2=O)C(OC)C1O |
|
GD119849 | -4.1 | 394.37 | C16H26O11 | CC1(O)C(O)CC2(O)C(CO)=COC(OC3OC(CO)C(O)C(O)C3O)C21 |
|
GD119850 | 3.01 | 358.48 | C19H34O6 | CC1OC(OCCCCCCCCCCC=CC(=O)O)C(O)CC1O |
|
GD119851 | -0.1 | 452.46 | C22H28O10 | O=C(O)Cc1ccccc1OC1OC(COC(=O)CC2=CCC(O)CC2)C(O)C(O)C1O |