aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD05151 | -1.44 | 562.53 | C26H30O12N2 | COC1(C(=O)O)CC(O)C(NC(=O)CO)C(C(O)C(O)CNC(=O)c2ccc(-c3ccc(C(=O)O)cc3)cc2)O1 |
|
AD05152 | -9.42 | 1622.81 | C72H111O22N21 | CC(C)CC(NC(=O)C(CO)NC(=O)C(CC(N)=O)NC(=O)C(CC(C)C)NC(=O)C(C)NC(=O)C(CC(N)=O)NC(=O)C(CC(N)=O)NC(=O)C(C)(C)NC(=O)C(CC(C)C)NC(=O)C(CC(N)=O)NC(=O)CNC(=O)CNC(=O)C(Cc1ccccc1)N(C)C(=O)CNC(=O)C(C)NC(=O)C(N)Cc1ccc(O)cc1)C(N)=O |
|
AD05153 | -1.08 | 548.55 | C26H32O11N2 | COC1(C(=O)O)CC(O)C(NC(=O)CO)C(C(O)C(O)CNCc2ccc(-c3cccc(C(=O)O)c3)cc2)O1 |
|
AD05154 | -1.21 | 532.55 | C26H32O10N2 | COC1(C(=O)O)CC(O)C(NC(=O)CO)C(C(O)C(O)CNC(=O)Cc2ccc(-c3ccccc3)cc2)O1 |
|
AD05155 | 4.83 | 430.63 | C27H42O4 | CC1CCC2(OC1)OC1CC3C4CC=C5CC(O)CCC5(C)C4CCC3(C)C1(O)C2C |
|
AD05156 | 1.39 | 277.65 | C11H6O2N6Cl | O=C(NNc1nc(Cl)nc2c1N=C[N]2)c1ccco1 |
|
AD05157 | -0.44 | 140.14 | C6H8O2N2 | CCn1c(=O)cc[nH]c1=O |
|
AD05158 | -1.69 | 333.31 | C13H15O4N7 | Cn1cc(COC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)nn1 |
|
AD05159 | -0.86 | 1088.88 | C31H44O21N6P4S4 | COP(O)(=S)OC1CC(n2cc(C)c(=O)[nH]c2=O)OC1COP(O)(=S)OC1CC(n2cc(C)c(=O)[nH]c2=O)OC1COP(O)(=S)OC1CC(n2cc(C)c(=O)[nH]c2=O)OC1COP(O)(O)=S |
|
AD05160 | -6.27 | 1677.1 | C67H138O13N33PS | COP(O)(=S)OCCCC(=O)NC(CCCCNC(=N)N)C(=O)NC(CCCCNC(N)N)C(=O)NC(CCCCNC(=N)N)C(=O)NC(CCCCNC(=N)N)C(=O)NC(CCCCNC(=N)N)C(=O)NC(CCCCNC(=N)N)C(=O)NC(CCCCNC(=N)N)C(=O)NC(CCCCNC(=N)N)C(=O)NCCCCCCO |