natural glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD120062 | 4.67 | 883.08 | C46H74O16 | COC1C(=O)CC2CC(OC3OCC(OC(C)=O)C(OC4OC(C)C(OC)C(OC)C4OC)C3OC)C(C)C(CC(=O)OC(C=CC=CC=CC(C)C)C(C)(C)C(O)CC1C)O2 |
|
GD120063 | 3.09 | 664.88 | C37H60O10 | COCC1OC(OC(=O)C23CCC(C)C(C)(O)C2C2=CCC4C5(C)CC(O)C(O)C(C)(C)C5CCC4(C)C2(C)CC3)C(O)C(O)C1O |
|
GD120064 | -1.77 | 1059.21 | C52H82O22 | CC1(C)CC2C3=CCC4C5(C)CCC(OC6OC(COC7OCC(O)C(O)C7OC7OC(CO)C(O)C7O)C(O)C(O)C6OC6OC(CO)C(O)C(O)C6O)C(C)(C)C5CCC4(C)C3(C)CC(O)C23CC1OC3=O |
|
GD120065 | 2.08 | 638.58 | C32H30O14 | COc1cc(C=CC(=O)OC2C(c3c(O)cc4oc(-c5ccc(O)c(OC)c5)cc(=O)c4c3O)OC(CO)C(O)C2O)ccc1O |
|
GD120066 | -1.43 | 417.44 | C17H23O9NS | CC1(C)C(COC2OC(CO)C(O)C(O)C2O)=CC(=O)C2=C1SC(O)C(O)=N2 |
|
GD120067 | 1.13 | 493.55 | C25H35O9N | CCCC(=O)c1c(C)cc2cc(OC)cc(OC3OC(C(O)CCCN)C(O)C(O)C3O)c2c1O |
|
GD120068 | 0.37 | 679.76 | C34H49O13N | CC1C=CC=CC=CC=CC(OC2OC(C)C(O)C(N)C2O)CC2OC(O)(CC(O)CC3OC3C=CC(=O)OC1C)CC(O)C2C(=O)O |
|
GD120069 | 3.62 | 1043.25 | C53H86O20 | COC1CC(OC2CCC3(C)C(=CCC4C3C(OC(C)=O)C(OC(C)=O)C3(C)C(C(C)O)CCC43O)C2)OC(C)C1OC1CC(OC)C(OC2CC(OC)C(OC3OC(C)C(O)C(OC)C3O)C(C)O2)C(C)O1 |
|
GD120070 | -4.4 | 702.66 | C31H42O18 | C=C1CCC2C(C(=O)OC3C4C=COC(OC5OC(CO)C(O)C(O)C5O)C4C4(CO)OC34)=COC(OC3OC(CO)C(O)C(O)C3O)C12 |
|
GD120071 | 6.43 | 772.03 | C44H69O10N | CCC=CC1CCCC(OC2CCC(N(C)C)C(C)O2)C(C)C(=O)C2=CC3C(C=C(C)C4CC(OC5OC(C)C(OC)C(OC)C5OC)CC43)C2CC(=O)O1 |