natural glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD115343 | 0.96 | 919.15 | C44H86O19 | CCC(O)COCC1OC(OC2C(COCC(O)CC)OC(OCC(O)CC)C(OCC(O)CC)C2OCC(O)CC)C(OCC(O)CC)C(OCC(O)CC)C1OCC(O)CC |
|
GD115344 | 2.18 | 1211.31 | C59H86O26 | COC(C(=O)C(O)C(C)O)C1Cc2cc3cc(OC4CC(OC5CC(O)C(OC(C)=O)C(C)O5)C(OC)C(C)O4)c(C)c(O)c3c(O)c2C(=O)C1OC1CC(OC2CC(OC3CC(C)(O)C(OC(=O)C(C)C)C(C)O3)C(O)C(C)O2)C(O)C(C)O1 |
|
GD115345 | -1.62 | 469.49 | C22H31O10N | CC1OC(OCC2OC(OCCc3c[nH]c4ccccc34)C(O)C(O)C2O)C(O)C(O)C1O |
|
GD115346 | -4.53 | 1719.83 | C81H122O39 | COc1ccc(C=CC(=O)OC2C(C)OC(OC(=O)C34CCC(C)(C)CC3C3=CCC5C6(C)CC(O)C(OC7OC(CO)C(O)C(O)C7O)C(C)(C(=O)O)C6CCC5(C)C3(CO)CC4)C(OC3OC(C)C(OC4OCC(OC5OC(CO)C(O)C(O)C5O)C(O)C4O)C(OC4OC(C)C(O)C(O)C4O)C3O)C2OC2OC(C)C(O)C(O)C2O)cc1 |
|
GD115347 | 0.74 | 494.54 | C25H34O10 | Cc1cc(=O)c2cc3c(cc2o1)OC(C)(C1CCCC1)C(OOCC(O)C(O)C(O)C(O)CO)C3 |
|
GD115348 | 4.94 | 1257.51 | C64H104O24 | COC1CC2(COC3CC(OC(C)C4(O)CCC5C6(C)CC=C7CC(O)CCC7(C)C6CCC54C)OC(C)C3OO2)OC(C)C1OC1CC(O)C(OC2CC(O)C(OC3CC(OC)C(OC4OC(C)C(O)C(OC)C4OC(C)=O)C(C)O3)C(C)O2)C(C)O1 |
|
GD115349 | 0.1 | 464.42 | C22H24O11 | COc1cc(C2Oc3cc(O)cc(O)c3C=C2OC2OC(CO)C(O)C(O)C2O)ccc1O |
|
GD115350 | -0.16 | 465.43 | C22H25O11 | COc1cc(C2Oc3cc(O)cc(O)c3C=C2OC2OC(C[OH2+])C(O)C(O)C2O)ccc1O |
|
GD115351 | -2.56 | 756.41 | C20H27O16N10P3 | Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(OCC2OC(n3cnc4c(N)ncnc43)C(O)C2O)OP(=O)(O)O)C(O)C1O |
|
GD115352 | 5.27 | 834.14 | C44H83O13N | CCCC=CC(O)C(COC1OC(CO)C(OC2OC(CO)C(O)C(O)C2O)C(O)C1O)N=C(O)CCCCCCCCCCCCCCCCCCCCCCC |