natural glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD121032 | -1.36 | 973.12 | C48H76O20 | CC1(C)CCC2(C(=O)OC3OC(CO)C(O)C(O)C3O)CCC3(C)C(=CCC4C5(C)CCC(OC(=O)C6OC(O)C(OC7OC(CO)C(O)C(O)C7O)C(O)C6O)C(C)(C)C5CCC43C)C2C1O |
|
GD121033 | -3.17 | 516.45 | C22H28O14 | O=C(C=Cc1ccc(O)c(OC2OC(CO)C(O)C(O)C2O)c1)OC1C(O)CC(O)(C(=O)O)CC1O |
|
GD121034 | -0.22 | 440.45 | C21H28O10 | O=C(C=Cc1ccc(O)c(O)c1)OC1C(O)C(CO)OC(OC2CCCCC2O)C1O |
|
GD121035 | -0.76 | 422.34 | C19H18O11 | O=c1c2c(O)cc(O)cc2oc2ccc(O)c(OC3OC(CO)C(O)C(O)C3O)c12 |
|
GD121036 | 1.17 | 973.74 | C32H46O20N7P3S | CC(C)(COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O)C(O)C(O)=NCCC(O)=NCCSC(=O)C(CC(=O)O)C(O)c1ccccc1 |
|
GD121037 | 0.93 | 692.75 | C32H52O16 | CCC(C)CC(=O)OC1C(OC(=O)C(C)CC)C(CO)OC(OC2(CO)OC(COC(C)=O)C(O)C2OC(C)=O)C1OC(=O)C(C)CC |
|
GD121038 | 2.77 | 1175.06 | C54H62O29 | COc1cc(OC(C)=O)c2c(=O)c(OC3OC(COC4OC(C)C(OC(C)=O)C(OC5OC(C)C(OC(C)=O)C(OC(C)=O)C5OC(C)=O)C4OC(C)=O)C(OC(C)=O)C(OC(C)=O)C3OC(C)=O)c(-c3ccc(OC(C)=O)cc3)oc2c1 |
|
GD121039 | 0.2 | 680.79 | C35H52O13 | CC1OC(OC2C=C3CCC4C(CCC5(C)C(C6=CC(=O)OC6)CCC45O)C3(C)CC2)C(O)C(O)C1OC1OC(CO)C(O)C(O)C1O |
|
GD121040 | -0.24 | 610.66 | C32H38O10N2 | CC(C)C(CNCC1(O)C(Oc2ccc3c(c2)OCC(=C2C=CC(O)=C[CH-]2)C3=O)OC(C(=O)O)C(O)C1O)CC1=CC[NH+]=C1 |
|
GD121041 | 1.3 | 530.48 | C26H26O12 | COc1ccc(-c2c(OC(=O)CC(=O)O)oc3cc(OC4OC(CO)C(C)C(O)C4O)ccc3c2=O)cc1 |