aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD06691 | 3.27 | 794.08 | C43H75O10N3 | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)CN(CCCNC(=O)CCCCc2ccccc2)C(C)C(O)C1(C)O |
|
AD06692 | 0.89 | 510.52 | C22H26O10N2S | O=C(NC1CC(NC(=O)OCc2ccccc2)C(OS(=O)(=O)O)C(O)C1O)OCc1ccccc1 |
|
AD06693 | -0.93 | 402.19 | C10H16O11N2P2 | COP(=O)(O)OP(=O)(O)OC1CC(n2ccc(=O)[nH]c2=O)OC1CO |
|
AD06694 | 1.83 | 211.3 | C7H7N4S2 | CSc1nc2c(c(SC)n1)N=C[N]2 |
|
AD06695 | 0.5 | 144.2 | C5H8ON2S | CSC1C=CNC(=O)N1 |
|
AD06696 | 9.44 | 915.22 | C56H68O3N9 | CN1C(=CC=CC=CC2=[N+](CCCCCCC(=O)NCCCCCCn3cc(CCC#Cc4cccc(CON=c5cc[nH]c(=O)[nH]5)c4)nn3)c3ccccc3C2(C)C)C(C)(C)c2ccccc21 |
|
AD06697 | 1.43 | 262.27 | C12H14O3N4 | CCCc1nc2cc(C(=O)NNC(=O)O)ccc2[nH]1 |
|
AD06698 | 2.5 | 346.73 | C16H11O4N4Cl | O=C(O)NNC(=O)c1ccc2[nH]c(-c3cccc(Cl)c3O)nc2c1 |
|
AD06699 | 5.57 | 572.83 | C35H56O6 | CC=C(C)C(=O)OC1CC(C)(C)CC2C3=CCC4C5(C)CCC(O)C(C)(CO)C5CCC4(C)C3(C)CC(O)C12CO |
|
AD06700 | 4.87 | 275.22 | C16H20OCl2 | CC(O)CCCCCCc1ccc(Cl)cc1Cl |