natural glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD117882 | -0.94 | 338.27 | C15H14O9 | O=C(O)C1OC(Oc2cc3ccccc3oc2=O)C(O)C(O)C1O |
|
GD117883 | -1.97 | 686.62 | C33H34O16 | Cc1cc(OC2OC(CO)C(O)C(O)C2O)c2c(c1)C(O)(C1OC(OC(=O)c3ccccc3)C(O)C(O)C1O)c1cc(O)cc(O)c1C2=O |
|
GD117884 | -3.56 | 1281.44 | C61H100O28 | COC(=O)C1OC(OC2CCC3(C)C(CCC4(C)C3CC=C3C5CC(C)(C)CC(OC6OC(CO)C(O)C(O)C6OC6OC(CO)C(O)C(O)C6O)C5(C)CCC34C)C2(C)CO)C(OC2OC(CO)C(O)C(O)C2OC2OC(C)C(O)C(O)C2O)C(O)C1O |
|
GD117885 | -2.15 | 390.34 | C16H22O11 | O=C(O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C(C(=O)O)CCC12 |
|
GD117886 | 2.22 | 802.98 | C39H62O15S | CC1CCC2(OC1)OC1CC3C4CC=C5CC(OC6OC(COC7OC(C)C(O)C(OS(=O)(=O)O)C7O)C(O)C(O)C6O)CCC5(C)C4CCC3(C)C1C2C |
|
GD117887 | 3.0 | 692.89 | C38H60O11 | CC(=O)OC1CC2(C)C(CCC3(C)C2CC=C2C4C(C(=O)OCC5OC(O)C(O)C(O)C5O)(CCC(C)C4(C)O)CCC23C)C(C)(C)C1O |
|
GD117888 | 4.54 | 1177.41 | C56H105O23P | CCCCCCCCCCCCCCCCCCCC(=O)OCC(COP(=O)(O)OC1C(OC2OC(CO)C(O)C(O)C2O)C(O)C(O)C(O)C1OC1OC(CO)C(O)C(O)C1O)OC(=O)CCCCCCCCCCCCCC |
|
GD117889 | 3.83 | 576.77 | C33H52O8 | CC1CCC2(OC1)OC1CC3C4CC(OC5OCC(O)C(O)C5O)C5(C)CC(=O)CCC5(C)C4CCC3(C)C1C2C |
|
GD117890 | 6.08 | 785.97 | C43H63O12N | CC(=O)OCC1OC(OC2CCC3(C)C(=CCC4C3CCC3(C)C4CC(OC(C)=O)C3C(C)C3=NCC(C)CC3)C2)C(OC(C)=O)C(OC(C)=O)C1OC(C)=O |
|
GD117891 | 2.99 | 638.88 | C36H62O9 | CC(C)(O)C1CCC2(CO)CCC3(C)C(CCC4C5(C)CCC(OC6OC(CO)C(O)C(O)C6O)C(C)(C)C5C(O)CC43C)C12 |