aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD00751 | -0.99 | 133.21 | C6H17ON2 | C[N+](C)(C)CC(O)CN |
|
AD00752 | 1.55 | 168.13 | C5H13O4P | CCCCOP(=O)(O)OC |
|
AD00753 | 4.99 | 1226.01 | C62H50O17N8Cl2 | CN(C)C(=O)C1NC(=O)C2NC(=O)C(NC(=O)C3NC(=O)C4NC(=O)C(Cc5ccc(c(Cl)c5)Oc5cc3cc(c5O)Oc3ccc(cc3Cl)C2O)NC(=O)C(N)c2ccc(O)c(c2)Oc2cc(O)cc4c2)c2ccc(O)c(c2)-c2c(O)cc(O)cc21 |
|
AD00754 | 1.88 | 393.59 | C19H39O5NS | CCCCCCCCCCCC[S+]([O-])CCC(=O)NC(CO)(CO)CO |
|
AD00755 | 3.48 | 423.6 | C26H37O2N3 | Cc1ccccc1Cc1ccc(CCCC(=O)NC(C)(C)C(=O)NCCN(C)C)cc1 |
|
AD00756 | 5.11 | 300.49 | C21H32O | C=CC1CCC2C3CC=C4CC(O)CCC4(C)C3CCC12C |
|
AD00757 | -0.75 | 97.1 | C3H5N4 | CC1=NC(N)=N[N]1 |
|
AD00758 | 0.72 | 168.15 | C8H8O4 | O=C(O)Cc1ccc(O)c(O)c1 |
|
AD00759 | 1.2 | 676.89 | C34H64O11N2 | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C(C)C)C2O)C(C)(O)CC(C)C(OCC(=O)NC)C(C)C(O)C1(C)O |
|
AD00760 | 6.67 | 312.54 | C20H40O2 | CCCCCCCCC(CCCCCCCC)CC(=O)OC |