aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD03361 | 2.38 | 269.3 | C16H15O3N | COC(=O)C1CCn2c(C(=O)c3ccccc3)ccc21 |
|
AD03362 | 1.71 | 164.2 | C10H12O2 | COC(=O)Cc1ccc(C)cc1 |
|
AD03363 | 1.62 | 150.18 | C9H10O2 | Cc1ccc(CC(=O)O)cc1 |
|
AD03364 | 2.73 | 205.3 | C13H19ON | CNCc1cccc(OC2CCCC2)c1 |
|
AD03365 | 0.44 | 116.12 | C5H8O3 | CC(=O)CCC(=O)O |
|
AD03366 | 5.95 | 506.15 | C12H7O2F17 | COC(=O)CCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F |
|
AD03367 | -0.49 | 114.12 | CH6O4S | CO[SH+]([O-])(O)O |
|
AD03368 | 0.57 | 147.13 | C8H5O2N | O=C1NC(=O)c2ccccc21 |
|
AD03369 | -0.58 | 100.09 | H4O4S | [O-][SH+](O)(O)O |
|
AD03370 | -15.75 | 4980.5 | C225H333O73N53S | CCC(C)C(NC(=O)C(CC(C)C)NC(=O)C(CO)NC(=O)C(Cc1cnc[nH]1)NC(=O)C(NC(=O)C(CC(C)C)NC(=O)C(CO)NC(=O)C(NC(=O)C(Cc1ccc(O)cc1)NC(=O)C(CSC1CC(=O)N(CCC(=O)NCCOCCOCCOCCOCCC(N)=O)C1=O)NC(C)=O)C(C)O)C(C)CC)C(=O)NC(CCC(=O)O)C(=O)NC(CCC(=O)O)C(=O)NC(CO)C(=O)NC(CCC(N)=O)C(=O)NC(CC(N)=O)C(=O)NC(CCC(N)=O)C(=O)NC(CCC(N)=O)C(=O)NC(CCC(=O)O)C(=O)NC(CC(C)C)C(=O)NC(CC(N)=O)C(=O)NC(CCC(=O)O)C(=O)NC(CCC(N)=O)C(=O)NC(CCC(=O)O)C(=O)NC(CC(C)C)C(=O)NC(CC(C)C)C(=O)NC(CCC(=O)O)C(=O)NC(CC(C)C)C(=O)NC(CC(=O)O)C(=O)NC(CC(C)C)C(=O)NC(Cc1c[nH]c2ccccc12)C(=O)NC(C)C(=O)NC(CO)C(=O)NC(CC(C)C)C(=O)NC(Cc1c[nH]c2ccccc12)C(=O)NC(CC(N)=O)C(=O)NC(Cc1c[nH]c2ccccc12)C(=O)NC(Cc1ccccc1)C(N)=O |