natural glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD119462 | -0.66 | 1059.21 | C52H82O22 | CC1(C)CCC2(C(=O)OC3OC(CO)C(O)C(O)C3O)CCC3(C)C(=CCC4C5(C)CCC(OC6OC(C(=O)O)C(OC7OC(CO)C(O)C7OC7OC(CO)C(O)C7O)C(O)C6O)C(C)(C)C5CCC43C)C2C1 |
|
GD119463 | 2.29 | 548.67 | C30H44O9 | COC1CC(OC2CCC3(C)C(CCC4C3C(O)C(=O)C3(C)C(C5=CC(=O)OC5)CCC43O)C2)OC(C)C1O |
|
GD119464 | 2.85 | 626.7 | C31H46O13 | CC(=O)OCC1OC(OC2C=C(C)CC(OC(C)=O)C=C(C)CCC2C(C)(C)O)C(OC(C)=O)C(OC(C)=O)C1OC(C)=O |
|
GD119465 | 0.47 | 696.83 | C36H56O13 | CC1(C)CCC2(C(=O)OC3OC(CO)C(O)C(O)C3O)CCC3(C)C(=CCC4C5(C)CC(O)C(O)C(CO)(C(=O)O)C5CCC43C)C2C1O |
|
GD119466 | -5.45 | 1096.95 | C48H56O29 | O=C(C=Cc1ccc(O)c(O)c1)OC1C(OC2C(Oc3c(-c4ccc(O)cc4)oc4cc(OC5OC(CO)C(OC6OC(CO)C(O)C(O)C6O)C(O)C5O)cc(O)c4c3=O)OC(CO)C(O)C2O)OC(CO)C(O)C1O |
|
GD119467 | -4.49 | 1485.62 | C69H112O34 | COC1C(O)C(CO)OC(OC2C(O)C(CO)OC(OC3COC(OC4CCC5(C)C6CCC78C(=O)OC(C)(CC(CC(C)C)OC(C)=O)C7CCC8(C)C6=CCC5C4(C)C)C(OC4OC(CO)C(OC5OC(CO)C(O)C(OC6OC(CO)C(O)C(OC)C6O)C5O)C(O)C4O)C3O)C2O)C1O |
|
GD119468 | 6.31 | 773.93 | C45H51O7N5 | CC(O)=NC1C(C)OC(Oc2ccc(C=CN=C(O)C(Cc3cn(C)c4ccccc34)NC(Cc3ccccc3)C(O)=NCCc3ccccc3)cc2)C(O)C1O |
|
GD119469 | 2.36 | 969.13 | C49H76O19 | COC1CC(OC2C(C)OC(OC3C(C)OC(OC4C(C)OC(OC5C=C6C=CC7(O)C(CCC89COC%10(C)OCC(OC78O)C%109)C6(C)CC5)C(O)C4OC)CC3OC)CC2OC)OC(C)C1O |
|
GD119470 | -0.07 | 432.43 | C22H24O9 | COc1c(O)ccc2c1C(=O)c1cc(O)c(C)cc1C2C1OC(CO)C(O)C(O)C1O |
|
GD119471 | 2.64 | 650.85 | C36H58O10 | CC(C)(O)C1CCC(C)(C2C(O)CC3(C)C4CC=C5C(CCC(OC6OC(CO)C(O)C(O)C6O)C5(C)C)C4(C)C(=O)CC23C)O1 |