natural glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD114883 | -0.75 | 468.37 | C20H20O13 | O=C(OCC1OC(Oc2ccc(O)c(C(=O)O)c2)C(O)C(O)C1O)c1cc(O)c(O)c(O)c1 |
|
GD114884 | -0.75 | 401.44 | C17H23O8NS | CC1(C)C(COC2OC(CO)C(O)C(O)C2O)=CC(=O)C2=C1SCC(O)=N2 |
|
GD114885 | -4.11 | 632.64 | C25H36O8N12 | Nc1ncnc2c1[nH]c(=NCCCCCN=c1[nH]c3c(N)ncnc3n1C1OC(CO)C(O)C1O)n2C1OC(CO)C(O)C1O |
|
GD114886 | 5.7 | 1158.39 | C61H91O20N | COC(O)=NC1C(C)OC(OC2CC=C(C)C3C=CC4C(OC5CC(OC6CC(C)C(OC7CC(O)C(OC)C(C)O7)C(O)O6)C(O)C(C)O5)C(C)CC(C)C4C3(C)C(=O)C3=C(O)C4(CC(C)C(CO)=CC4C=C2C)OC3=O)CC1(C)O |
|
GD114887 | 4.25 | 659.04 | C32H31O12N2Cl | COc1cc(C(O)=Nc2c(O)c3ccc(OC4OC(C)(C)C(OC)C(O)C4OC(=O)c4ccc(C)[nH]4)c(Cl)c3oc2=O)ccc1O |
|
GD114888 | 0.19 | 817.02 | C42H72O15 | CC(CO)C1CCC2(CCC3(C)C(CCC4C5(C)CCC(OC6OC(CO)C(O)C(O)C6O)C(C)(COC6OC(CO)C(O)C(O)C6O)C5CCC43C)C2O)CO1 |
|
GD114889 | -1.62 | 508.48 | C24H28O12 | O=C(C=Cc1ccc(O)cc1)OCC1OC(OC2OC=CC3C(O)C4OC4(CO)C23)C(O)C(O)C1O |
|
GD114890 | 0.07 | 492.43 | C23H24O12 | COc1cc(O)c2c(=O)c(O)c(-c3ccc(OC4OC(CO)C(O)C(O)C4O)c(OC)c3)oc2c1 |
|
GD114891 | 0.36 | 476.43 | C23H24O11 | COc1cccc(-c2cc(=O)c3c(O)c(OC)c(OC4OC(CO)C(O)C(O)C4O)cc3o2)c1 |
|
GD114892 | -0.83 | 1075.25 | C53H86O22 | CC1OC(OC2C(OC3C(OC4CCC5(C)C(CCC6(C)C5CC=C5C7CC(C)(C)CC(OC8OC(CO)C(O)C(O)C8O)C7(C)CCC56C)C4(C)CO)OC(C(=O)O)C(O)C3O)OCC(O)C2O)C(O)C(O)C1O |