aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD12391 | 9.09 | 579.95 | C36H69O4N | CCCCCCCCCC=CCCC=CC(O)C(CO)NC(=O)C(O)CCCCCCCCCCCCCCCC |
|
AD12392 | 4.58 | 486.69 | C30H46O5 | CC1CC2OC3(OC2C(C)(C)O)C1C1(C)CCC24CC25CCC(O)C(C)(C)C5CC=C4C1(C)C3O |
|
AD12393 | 0.22 | 114.15 | C3H4N3S | CC1=NN=C(S)[N]1 |
|
AD12394 | -0.66 | 212.2 | C10H12O5 | COC(=O)C=CC1(O)C=CC(O)CC1=O |
|
AD12395 | 6.78 | 514.75 | C32H50O5 | CC(=O)OC1(C)C(C)CCC2(C(=O)O)CCC3(C)C(=CCC4C5(C)CCC(O)C(C)(C)C5CCC43C)C21 |
|
AD12396 | 2.23 | 177.29 | C8H17O2S | CCCCCCCC[S](=O)=O |
|
AD12397 | 3.67 | 824.93 | C44H52O10N6 | Cc1c2oc3c(C)ccc(C(=O)Nc4cccc(CNC5(C)CC(O)OC(C)C5O)c4)c3nc-2c(C(=O)Nc2cccc(CNC3(C)CC(O)OC(C)C3O)c2)c(N)c1=O |
|
AD12398 | 8.88 | 2788.45 | C140H128O36N22Cl4 | CNC(CC(C)C)C(=O)NC1C(=O)NC(CC(N)=O)C(=O)NC2C(=O)NC3C(=O)NC(C(=O)NC(C(=O)NCc4cccc(NC(=O)c5c6nc7c(C(=O)Nc8cccc(CNC(=O)C9NC(=O)C%10NC(=O)C(NC(=O)C%11NC(=O)C(CC(N)=O)NC(=O)C(NC(=O)C(CC(C)C)NC)C(O)c%12ccc(c(Cl)c%12)Oc%12cc%11cc(c%12O)Oc%11ccc(cc%11Cl)C%10O)c%10ccc(O)c(c%10)-c%10c(O)cc(O)cc%109)c8)ccc(C)c7oc-6c(C)c(=O)c5N)c4)c4cc(O)cc(O)c4-c4cc3ccc4O)C(O)c3ccc(c(Cl)c3)Oc3cc2cc(c3O)Oc2ccc(cc2Cl)C1O |
|
AD12399 | 1.72 | 441.57 | C25H35O4N3 | CC1C(N)CC(NC(=O)C(CCN)OCc2ccccc2)C(O)C1OCc1ccccc1 |
|
AD12400 | 3.84 | 282.42 | C17H30O3 | COC(=O)CCCCCCC#CCCCCCCCO |