natural glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD117412 | 0.64 | 650.72 | C30H50O15 | CCCCCC(=O)OC1C(CO)OC(OC2(CO)OC(CO)C(O)C2OC(=O)CCCCC)C(OC(C)=O)C1OC(=O)C(C)C |
|
GD117413 | -2.59 | 1095.28 | C53H90O23 | C=C(C)C(O)CCC(C)(OC1OC(COC2OC(CO)C(O)C2O)C(O)C(O)C1O)C1CCC2(C)C1C(O)CC1C3(C)CCC(OC4OC(CO)C(O)C(O)C4OC4OC(CO)C(O)C(O)C4O)C(C)(C)C3CCC12C |
|
GD117414 | 0.54 | 879.02 | C42H66O14N6 | CCCCCC(=O)OC1CC2CC(C(O)=NCCCCNC(=N)N)N(C(=O)C(CC(C)C)N(C)C(=O)C(O)Cc3ccc(O)cc3)C2CC1OC1OC(C(=O)O)C(O)C(O)C1O |
|
GD117415 | -0.44 | 1137.32 | C55H92O24 | COC1CC(OC2CCC3(C)C(=CCC4(O)C3CC(O)C3(C)C(O)(C(C)O)CCC43O)C2)OC(C)C1OC1CC(OC)C(OC2CC(OC)C(OC3OC(C)C(OC4OC(CO)C(O)C(O)C4O)C(OC)C3O)C(C)O2)C(C)O1 |
|
GD117416 | -0.12 | 434.4 | C21H22O10 | O=C(C=Cc1ccc(OC2OC(CO)C(O)C(O)C2O)c(O)c1)c1ccc(O)cc1O |
|
GD117417 | 9.51 | 1660.14 | C85H150O27N4 | CCCCCCCCCCCCCCCCCCCCCCCCCCCCCC(O)CC(O)=NC(Cc1ccccc1)C(O)=NC(C(O)=NC(C)C(O)=NC(C)COC1OC(C)C(OC)C(OC)C1O)C(C)OC1OC(C)C(O)C(O)C1OC1OC(C)C(O)C(OC2OC(C)C(OC3OC(C)C(OC)C(O)C3O)C(O)C2OC)C1O |
|
GD117418 | 0.64 | 913.11 | C47H76O17 | CC1(C)CC(C(=O)OC2OC(COC3OC(CO)C(O)C(O)C3O)C(O)C(O)C2O)C2CCC3(C)C(=CCC4C5(C)CCC(OC6OCC(O)C(O)C6O)C(C)(C)C5CCC43C)C2C1 |
|
GD117419 | 3.37 | 852.89 | C47H48O15 | CC(=O)Oc1cc(CO)c2c(c1C=Cc1cccc(CCO)c1)C(=O)c1cc(OC3OC(C)C(O)C(O)(O)C3O)c(Cc3cccc(C4(O)CCCCC4)c3C=O)c(O)c1C2=O |
|
GD117420 | 13.31 | 1340.62 | C83H89O15N | CC(=O)N(Cc1ccccc1)C1C(OCc2ccccc2)OC(COCc2ccccc2)C(OC2OC(COCc3ccccc3)C(OCc3ccccc3)C(OCc3ccccc3)C2OC2OC(C)C(OCc3ccccc3)C(OCc3ccccc3)C2O)C1OCc1ccccc1 |
|
GD117421 | 2.58 | 1023.22 | C50H86O21 | CCCCCC1CCCCCCCCCC(=O)OC2C(O)C(C)OC(OC3C(O1)OC(C)C(O)C3O)C2OC1OC(C)C(OC2OC(C)C(OC(=O)C(C)C(C)O)C(O)C2O)C(O)C1OC(=O)C(C)CC |