aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD15511 | -0.43 | 158.25 | C8H18ON2 | OCCNCC1CCCNC1 |
|
AD15512 | 5.9 | 476.74 | C30H52O4 | CC(C)(O)CCCC(C)(O)C1CCC2(C)C1C(=O)CC1C3(C)CCC(O)C(C)(C)C3CCC12C |
|
AD15513 | 1.34 | 161.19 | C8H9N4 | CCCc1ncnc2c1N=C[N]2 |
|
AD15514 | 2.79 | 1426.33 | C70H78O20N10Cl2 | C#CCCC(=O)NCCCOCCOCCOCCCNC(=O)C1NC(=O)C2NC(=O)C(NC(=O)C3NC(=O)C(CC(N)=O)NC(=O)C(NC(=O)C(CC(C)C)NC)C(O)c4ccc(c(Cl)c4)Oc4cc3cc(c4O)Oc3ccc(cc3Cl)C2O)c2ccc(O)c(c2)-c2c(O)cc(O)cc21 |
|
AD15515 | -8.75 | 1506.59 | C71H91O22N15 | CC(=O)CC1NC(=O)C2Cn3c[nH+]c(c3)CC(NC(=O)CCCC(C(=O)[O-])NC(=O)C(O)CNC(=O)C(C(C)c3ccccc3)NC(=O)C(C(O)C(N)=O)NC1=O)C(=O)NC(C(C)O)C(=O)NC(CO)C(=O)NC(Cc1ccccc1)C(=O)NC(C(O)C=C(C)C=Cc1ccccc1)CC(=O)NC(CO)C(=O)N2 |
|
AD15516 | 1.98 | 303.25 | C12H18O6NP | CCOC(=O)CNP(=O)(OC)Oc1ccc(OC)cc1 |
|
AD15517 | 2.4 | 234.25 | C13H14O4 | Cc1c(O)c(C=O)c(O)c2c1OC(C)(C)C=C2 |
|
AD15518 | 1.98 | 727.99 | C37H69O9N5 | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)CN(CCCCc2cn(CC)nn2)C(C)C(O)C1(C)O |
|
AD15519 | 2.41 | 272.26 | C15H12O5 | O=C(C=Cc1ccc(O)cc1)c1c(O)cc(O)cc1O |
|
AD15520 | 5.02 | 542.76 | C33H50O6 | CC(=O)OC1CC23CC24CCC(O)C(C)(C)C4CCC3C2(C)CC3OC4(CC(C)C3C12C)CC(O)C1(C)OC41 |