aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD06461 | 2.58 | 390.52 | C23H34O5 | CC12CCC(O)CC1CCC1C2CCC2(C)C(C3=CC(=O)OC3)C(O)CC12O |
|
AD06462 | 2.42 | 278.4 | C16H26O2N2 | CCCCCCCCC1C(O)NC(=O)C2=CNC=CC21 |
|
AD06463 | 0.58 | 330.52 | C17H38O2N4 | C[N+](C)(C)CCCC(=O)NCCCNC(=O)CCC[N+](C)(C)C |
|
AD06464 | -1.08 | 520.54 | C25H32O10N2 | COC1(C(=O)O)CC(O)C(NC(=O)CO)C(C(O)C(O)CNCc2ccc(-c3cccc(O)c3)cc2)O1 |
|
AD06465 | 3.6 | 530.74 | C28H42O4N4S | CC(C)(C)S(=O)(=O)CC(Cc1ccccc1)C(=O)NC(Cc1c[nH]cn1)C(=O)NCCC1CCCCC1 |
|
AD06466 | 3.24 | 361.44 | C20H27O5N | CCN1C=C(C(=O)O)Cc2cc(CCCOCCCCC(=O)O)ccc21 |
|
AD06467 | -0.46 | 151.12 | C6H5O2N3 | O=c1[nH][nH]c(=O)c2[nH]ccc12 |
|
AD06468 | 3.13 | 474.47 | C25H22O6N4 | COCC(COC)NN1C(=O)c2c(c3c4ccc(O)cc4[nH]c3c3[nH]c4cc(O)ccc4c23)C1=O |
|
AD06469 | -1.39 | 151.1 | C5H3O2N4 | O=c1nc2n(c(=O)[nH]1)C=C[N]2 |
|
AD06470 | 2.81 | 1281.63 | C63H116O22N4 | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)CCN(C)C3CC(C)OC(OC4C(C)C(O)C(C)C(=O)OC(CC)C(C)(O)C(O)C(C)C(=NO)C(C)CC4(C)OC)C3O)C2O)C(C)(O)CC(C)C(=NOCOCCOC)C(C)C(O)C1(C)O |