natural glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD116343 | 7.6 | 1381.69 | C72H116O25 | CCCCCCCCCCCC(=O)OC1C(C)OC(OC2C(C)OC(OC3C(C)OC4OC5C(OC(CCCCC)CCCCCCCCCC(=O)OC4C3O)OC(C)C(O)C5O)C(OC(=O)C(C)CC)C2OC2OC(C)C(O)C(O)C2O)C(OC(=O)C=Cc2ccccc2)C1O |
|
GD116344 | -6.45 | 329.3 | C11H23O10N | NC1C(O)C(O)C(O)OC1C(O)C(O)C(O)C(O)C(O)CO |
|
GD116345 | 1.31 | 706.89 | C34H58O13S | CC(C)C(=CCO)CCC(C)C1C(O)C(O)C2C1(C)CCC1C3(C)CCC(OC4OCC(OS(=O)(=O)O)C(O)C4O)CC3C(O)CC12O |
|
GD116346 | -0.06 | 540.56 | C26H36O12 | C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C2C(=O)OC(OC(=O)C(C)=CCCC(C)=CCO)CC21 |
|
GD116347 | -0.42 | 408.43 | C20H26O8N | CC(C)CCc1ccc2[n-]c(CO)c(OC(=O)C3OC(O)(CO)C(O)C3O)c2c1 |
|
GD116348 | -0.05 | 814.7 | C38H38O20 | COc1cc(-c2cc(=O)c3c(O)cc(OC4OC(C(=O)O)C(O)C(O)C4OC4OC(COC(=O)C=Cc5ccc(O)cc5)C(O)C(O)C4O)cc3o2)cc(OC)c1O |
|
GD116349 | 1.29 | 711.81 | C38H49O12N | CC1CN2CC3CCC4=C5C(CC4)C(C(=O)OCC4OC(OC6OC=C(C(=O)O)C7CC=C(CO)C67)C(O)C(O)C4O)CC54C(=O)C1CC2C34C |
|
GD116350 | 4.62 | 602.81 | C35H54O8 | CC(C)(O)C=CCC(C(=O)OC1OCC(O)C(O)C1O)C1CCC2(C)C3=C(CCC12C)C1(C)CCC(=O)C(C)(C)C1CC3 |
|
GD116351 | -1.32 | 1187.38 | C59H94O24 | C=C1CCC2(C(=O)OC3OC(COC4OC(CO)C(OC5OC(C)C(O)C(O)C5O)C(O)C4O)C(O)C(O)C3O)CCC3(C)C(=CCC4C5(C)CCC(OC6OCC(O)C(O)C6OC6CC(C)C(O)C(O)C6O)C(C)(C)C5CCC43C)C2C1 |
|
GD116352 | -1.14 | 386.37 | C16H18O4N8 | Nc1ncnc2c1nc(NN=Cc1ccncc1)n2C1OC(CO)C(O)C1O |