aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD12401 | -0.66 | 194.17 | C7H8O2N5 | Nc1nc(OCCO)nc2c1N=C[N]2 |
|
AD12402 | 7.4 | 894.2 | C51H79O10N3 | CCC1OC(=O)CC(O)C(C)C(O)C(CCN2CC(C)CC(C)C2)CC(C)C(=NOCCCOc2ccc3ncccc3c2)C=CC(C)=CC1COC1CC(C)C(O)C(OC)C1OC |
|
AD12403 | 1.68 | 562.7 | C28H50O11 | CCCCCC1CCCCCCCCCC(=O)OCC2OC(OC3C(O1)OC(C)C(O)C3O)C(O)C(O)C2O |
|
AD12404 | 5.41 | 1198.62 | C65H115O18N | CC(=CCC(O)CC(O)CCC(C)C(O)C(C)C(O)CCCC(O)C(C)C(O)C(C)=CC(C)C(=O)C(C)=CC(O)C(O)CC(O)CC(O)C(C)CCC(O)CC(O)CCC(C)C(O)C(C)C(O)C(C)C)C(=O)C1=C(O)C(=CC(C)C)N(C)C1=O |
|
AD12405 | 4.1 | 488.49 | C28H24O8 | COC1=CC(=O)OC2(C=Cc3ccc(O)cc3)C1C(c1ccc(O)cc1)C2c1cc(OC)cc(=O)o1 |
|
AD12406 | 1.34 | 226.23 | C11H14O5 | COc1cc(CC(=O)O)cc(OC)c1OC |
|
AD12407 | 4.06 | 454.62 | C26H38O3N4 | CC(C)c1[nH]nc(O)c1Cc1ccc(CCCC(=O)NC(C)(C)C(=O)N2CCCCC2)cc1 |
|
AD12408 | 1.28 | 194.15 | C7H6O3N4 | Cc1onc(-c2ncc[nH]2)c1[N+](=O)[O-] |
|
AD12409 | 3.24 | 226.28 | C15H14O2 | Cc1cc(C(=O)c2ccccc2C)ccc1O |
|
AD12410 | 0.76 | 224.25 | C8H8O2N4S | NC(=S)NN=Cc1ccc([N+](=O)[O-])cc1 |