natural glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD116633 | -2.27 | 874.97 | C42H66O19 | COC1C(O)C(C)OC(OC2CC(O)C3(C)C(CCC4C3CCC3(C)C(C5=CC(=O)OC5)CCC43O)C2)C1OC1OC(COC2OC(CO)C(O)C(O)C2O)C(O)C(O)C1O |
|
GD116634 | 6.41 | 544.82 | C34H56O5 | C=C(CCC(C)C1CCC2C3CC=C4CC(OC5OC(C)C(O)C(O)C5O)CCC4(C)C3CCC12C)C(C)C |
|
GD116635 | 1.29 | 1123.29 | C57H86O22 | COC1CC(OC2CCC3(C)C(=CCC4(O)C3CC(OC(=O)C=Cc3ccccc3)C3(C)C(O)(C(C)O)CCC43O)C2)OC(C)C1OC1CC(OC)C(OC2OC(C)C(OC3OC(CO)C(O)C(O)C3O)C(OC)C2O)C(C)O1 |
|
GD116636 | 1.88 | 752.94 | C40H64O13 | CC1(C)CCC2(C(=O)OC3OC(O)C(O)C(O)C3O)CCC3(C)C(=CCC4C5(C)CCC(OC6OCC(O)C(O)C6O)C(C)(C)C5CCC43C)C2C1O |
|
GD116637 | 3.03 | 532.67 | C30H44O8 | COC1C(O)C(C)OC(OC2C=C3CCC4C(CCC5(C)C(C6=CC(=O)OC6)CCC45O)C3(C)CC2)C1O |
|
GD116638 | 8.12 | 1036.48 | C56H109O15N | CCCCCCCCCCCCCCCCCCCCCC(O)C(O)=NC(COC1OC(CO)C(O)C(O)C1OC1OC(CO)C(O)C(O)C1O)C(O)C(O)CCCCCCCCCCCCCCCCC |
|
GD116639 | -0.34 | 394.43 | C18H26O6N4 | OC(CC1OC(CN=C(O)N2CCOCC2)C(O)C1O)=NCc1cccnc1 |
|
GD116640 | -0.85 | 890.87 | C44H48O17N3 | C[NH2+]C(O)(CCO)C(C(=O)O)C(=O)OC(O)(CO)C1OC(Oc2ccc3c(=O)c(-c4ccc(O)cc4)coc3c2)C(CO)(ON2CC3=CC=NC3=C2c2cc(C)cc(C)c2)C(O)C1O |
|
GD116641 | -1.63 | 889.04 | C41H76O20 | COC(=O)CC(CCCCCCCCCCCC(CCCCCC(C)OC1OC(CO)C(O)C(O)C1O)OC1OC(CO)C(O)C(O)C1O)OC1OC(CO)C(O)C(O)C1O |
|
GD116642 | 0.64 | 590.53 | C28H30O14 | CCOC(=O)C=Cc1c(OC)cc2oc(-c3cc(O)c(OC4OC(CO)C(O)C(O)C4O)c(O)c3)cc(=O)c2c1OC |