aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD11811 | 0.74 | 359.15 | C10H12ON6I | O=C(CI)NCCCNc1ncnc2c1N=C[N]2 |
|
AD11812 | -14.92 | 2526.75 | C98H178O34N38P2S | COP(=O)(O)OP(=O)(O)OCC(C)(C)C(O)C(=O)NCCC(=O)NCCSCC(=O)NCCCCC(NC(=O)CNC(=O)C(CC(C)C)NC(=O)CNC(=O)C(CCCCN)NC(=O)CNC(=O)CNC(=O)C(CCCCN)NC(=O)CNC(=O)C(CCCNC(=N)N)NC(=O)CNC(=O)C(CO)NC(C)=O)C(=O)NCC(=O)NCC(=O)NC(C)C(=O)NC(CCCCN)C(=O)NC(CCCNC(=N)N)C(=O)NC(Cc1cnc[nH]1)C(=O)NC(CCCNC(=N)N)C(=O)NC(CCCCN)C(=O)O |
|
AD11813 | 0.64 | 170.26 | C9H18ON2 | CNC(=O)C(N)C1CCCCC1 |
|
AD11814 | 4.34 | 522.58 | C27H26O7N2S | CN(C)c1cccc2c(S(=O)(=O)Nc3cc(CCC(=O)c4c(O)cc(O)cc4O)ccc3O)cccc12 |
|
AD11815 | 0.95 | 232.24 | C12H12O3N2 | Cc1ccc(COc2c[nH]c(=O)[nH]c2=O)cc1 |
|
AD11816 | 3.4 | 599.81 | C32H57O9N | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C(C)C)C2O)C2(C)CC(C)=C(O2)C(C)C(O)C1(C)OC |
|
AD11817 | 3.91 | 862.14 | C44H71O10N5S | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)CN(CCCNC(=S)Nc2ccc(Oc3ccccc3)nc2)C(C)C(O)C1(C)O |
|
AD11818 | 10.46 | 670.12 | C41H83O5N | CCCCCCCCCCCCCCCCCCCCCCC(O)C(=O)NC(CO)C(O)C(O)CCCCCCCCCCCCC |
|
AD11819 | 2.8 | 200.37 | C12H28N2 | NCCCCCCCCCCCCN |
|
AD11820 | 6.53 | 500.6 | C29H47ON3Cl2 | CNCCCCCCCCCCCCNC(=O)CCCc1ccc(N(CCCl)CCCl)cc1 |