aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD05501 | 4.84 | 316.53 | C19H40O3 | CCCCCCCCCCCCCCCCOCC(O)CO |
|
AD05502 | 2.4 | 470.6 | C25H42O8 | CCC1OC(=O)CC(O)C(C)C(O)C(CC(OC)OC)CC(C)C(=O)C=CC(C)=CC1CO |
|
AD05503 | 1.28 | 151.16 | C8H9O2N | NC(=O)OCc1ccccc1 |
|
AD05504 | 1.06 | 430.46 | C22H26O7N2 | O=C(NC1CC(NC(=O)OCc2ccccc2)C(O)C(O)C1O)OCc1ccccc1 |
|
AD05505 | 8.87 | 658.82 | C30H60O9P2S | CCCCCCCCCCCCCCCC(=O)OC(COP(=O)([O-])OP(=O)([O-])OC)CSCCCCCCCCCC |
|
AD05506 | 9.23 | 584.84 | C36H56O6 | CCCCC1CCCCC(C)C(O)c2cc(O)c(c(O)c2)C(CCCC)CCCCC(C)C(O)c2cc(O)c1c(O)c2 |
|
AD05507 | 2.7 | 437.87 | C21H18O2N8Cl | O=C(NCc1ccc(Cl)cc1)c1cnn(-c2nc3c(c(NC4CCCO4)n2)N=C[N]3)c1 |
|
AD05508 | 5.26 | 670.93 | C37H66O10 | CCC1OC2(CCC(C)(C3CCC(C)(C4OC(C(O)C(C)CC(C)C(C)(C)O)CC4OC4CCC(OC)C(C)O4)O3)O2)CC(O)C1C |
|
AD05509 | 0.8 | 482.59 | C25H34O4N6 | CCn1c2ccccc2c2cc(NC(=O)C(CCCCN)NC(=O)CNC(=O)C(N)CO)ccc21 |
|
AD05510 | -0.95 | 128.02 | CH5O5P | O=P(O)(O)OCO |