natural glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD116723 | -0.22 | 481.43 | C22H25O12 | COc1cc([OH2+])cc2c1C(=O)C(OC1OC(C)C(O)C(O)C1O)C(c1cc(O)c(O)c(O)c1)O2 |
|
GD116724 | 2.91 | 820.97 | C43H64O15 | CC1(C(=O)O)CCC2(C)CCC3(C)C(=CC(=O)C4C5(C)CCC(OC6OC(C(=O)O)C(O)C(O)C6OC6CC(C(=O)O)C(O)C(O)C6O)C(C)(C)C5CCC43C)C2C1 |
|
GD116725 | 4.15 | 1163.38 | C55H103O23P | CCCCCCCCCCCCCCCCCC(=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)CCCCCCCCCCCCCCC |
|
GD116726 | -0.83 | 835.97 | C41H63O14N4 | CC(C)OC1C(OC2OC=C(C(=O)OC3CCCC3)C(C=CC3=C(NC(=[NH2+])NCCCO)C(C(=O)O)=CN(CCO)C3)C2C=C2CCCCC2)OC(CO)C(O)C1(O)O |
|
GD116727 | 0.53 | 474.42 | C23H22O11 | COC(=O)C1OC(Oc2cc3oc(-c4ccccc4)cc(=O)c3c(O)c2OC)C(O)C(O)C1O |
|
GD116728 | 1.02 | 346.42 | C17H30O7 | CC=C(C)COCC1OC(OCC(C)C)C(OC(C)=O)C(O)C1O |
|
GD116729 | 5.99 | 1468.86 | C73H133O26N3 | CCCCCCCCCCCCCC=CC(O)C(COC1OC(CO)C(OC2OC(CO)C(OC3OC(CO)C(O)C(O)C3N=C(C)O)C(OC3(C(=O)O)CC(O)C(N=C(C)O)C(C(O)C(O)CO)O3)C2O)C(O)C1O)N=C(O)CCCCCCCCCCCCCCCCCCCCCCC |
|
GD116730 | 2.02 | 692.76 | C35H48O14 | C=C1CC(OC(C)=O)C2(C)C(CC(=O)C3(C)C2CCC(C)(C(OC2OC(CO)C(O)C(O)C2O)c2ccoc2)C32OC2C(=O)O)C(C)(C)O1 |
|
GD116731 | 1.21 | 446.41 | C22H22O10 | CCC1OC(c2c(O)cc(O)c3c(=O)cc(-c4ccc(O)c(O)c4)oc23)C(O)C(O)C1O |
|
GD116732 | 2.68 | 1227.53 | C60H110O23N2 | CCCCCCCCCCCCCC=CC(O)C(COC1OC(CO)C(OC2OC(CO)C(OC3OC(CO)C(O)C(OC4OC(CO)C(O)C(O)C4N=C(C)O)C3O)C(O)C2O)C(O)C1O)N=C(O)CCCCCCCCCCCCCCC |