natural glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD117442 | 0.07 | 498.61 | C26H42O9 | CC1C2CC(O)C(C)(C)C23OC12CCC1CC2(CC3OC2OC(CO)C(O)C(O)C2O)CC1(C)O |
|
GD117443 | -0.6 | 1135.35 | C56H94O23 | CC(=O)OC1C(O)C(C)OC(OC2C(OC(C)(CCC=C(C)C)C3CCC4(C)C3C(O)CC3C5(C)CCC(OC6OC(CO)C(O)C(O)C6OC6OC(CO)C(O)C(O)C6O)C(C)(C)C5CCC34C)OC(CO)C(O)C2O)C1O |
|
GD117444 | 4.26 | 1185.39 | C57H101O23P | CCCCCCC=CCCCCCCCCCC(=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)C=CC=CCCCCCCCCCCCCC |
|
GD117445 | 6.57 | 1397.69 | C72H116O26 | CCCCCCCCCCCC(=O)OC1C(OC2C(C)OC3OC4C(OC(CCCCC)CCCCCCCCCC(=O)OC3C2O)OC(CO)C(O)C4O)OC(C)C(OC2OC(C)C(OC(=O)C(C)CC)C(O)C2OC(=O)C=Cc2ccccc2)C1OC1OC(C)C(O)C(O)C1O |
|
GD117446 | 7.08 | 834.1 | C49H71O10N | CCc1c[nH]cc1CCC12C3CCC4C=C5C(C)(CCC6(C(=O)O)C(COC)CC7(C)CC=CC56C7)C(C)(CCC1C(C)(C)C(OC1OC(C(=O)O)C(O)C(O)C1O)C3)C42 |
|
GD117447 | 2.87 | 834.69 | C40H34O20 | O=C(C=Cc1cc(O)c(O)c(C(Cc2ccc(O)c(O)c2)C(=O)O)c1)OC(C(=O)O)C(OC(=O)C=Cc1cc(O)c(O)c(C(Cc2ccc(O)c(O)c2)C(=O)O)c1)C(=O)O |
|
GD117448 | -2.01 | 696.57 | C30H32O19 | CC1OC(Oc2cc(O)c3c(=O)c(OC4OC(COC(=O)CC(=O)O)C(O)C(O)C4O)c(-c4ccc(O)c(O)c4)oc3c2)C(O)C(O)C1O |
|
GD117449 | 1.11 | 799.01 | C42H70O14 | CC1OC(OC2C(OC3CCC45CC46CCC4(C)C(C7(C)CCC(C(C)(C)O)O7)C(O)CC4(C)C6CC(O)C5C3(C)C)OC(CO)C(O)C2O)C(O)C(O)C1O |
|
GD117450 | 0.12 | 780.91 | C40H60O15 | CC1COC2(C)OC3C(C4CC=C5C6=C(CCC54C)C4(C)CCC(OC5OC(CO)C(O)C(OC7OCC(O)C(O)C7O)C5O)CC4CC6)C(O)OC3C12O |
|
GD117451 | 3.63 | 1040.98 | C53H52O22 | COc1cc(C=CC(=O)OCC2OC(OC3(COC(=O)C=Cc4ccc(O)cc4)OC(COC(=O)C=Cc4ccc(O)cc4)C(O)C3OC(=O)C=Cc3ccc(O)cc3)C(OC(C)=O)C(O)C2OC(C)=O)ccc1O |