aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD16721 | 0.84 | 124.08 | C3H9O3P | CCOP(C)(=O)O |
|
AD16722 | 7.03 | 597.88 | C37H59O5N | COC(=O)C(CC(C)C)NC(=O)C1(C)CCC2(C)CCC3(C)C(=CC(=O)C4C5(C)CCC(O)C(C)(C)C5CCC43C)C2C1 |
|
AD16723 | 0.32 | 173.21 | C8H15O3N | COC(=O)C(CC(C)C)NC=O |
|
AD16724 | 1.58 | 738.66 | C35H34O16N2 | COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)CC(O)(C(=O)CO)CC3OC1CC(NC(=O)OCc2cc([N+](=O)[O-])ccc2O)C(O)C(C)O1 |
|
AD16725 | 1.33 | 256.34 | C14H24O4 | CC(C)CC1(O)C(=O)C(C)(C)C(O)C(C)(C)C1=O |
|
AD16726 | 0.28 | 242.23 | C11H14O6 | C=CC1C(O)OC=C(C(=O)O)C1CC(=O)OC |
|
AD16727 | 1.18 | 138.13 | C6H6O2N2 | Nc1ccc([N+](=O)[O-])cc1 |
|
AD16728 | 4.45 | 284.36 | C18H20O3 | CCCCOc1ccc(C=Cc2cc(O)cc(O)c2)cc1 |
|
AD16729 | 5.94 | 627.86 | C37H57O7N | COC(=O)CCC(NC(=O)C1(C)CCC2(C)CCC3(C)C(=CC(=O)C4C5(C)CCC(O)C(C)(C)C5CCC43C)C2C1)C(=O)OC |
|
AD16730 | -0.77 | 203.19 | C8H13O5N | COC(=O)CCC(NC=O)C(=O)OC |