aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD12691 | 0.76 | 70.09 | C4H6O | C=C(C)C=O |
|
AD12692 | -1.0 | 74.08 | C2H6ON2 | CC(=O)NN |
|
AD12693 | 1.92 | 263.35 | C11H15N6S | CSc1nc2c(c(NN3CCCCC3)n1)N=C[N]2 |
|
AD12694 | 5.75 | 600.84 | C36H56O7 | CC=C(C)OC1C(O)C2(CO)C(OC(C)=O)CC3(C)C(=CCC4C5(C)CCC(O)C(C)(C=O)C5CCC43C)C2CC1(C)C |
|
AD12695 | 0.26 | 287.04 | CH6O9P3S | COP(=O)(S)OP(=O)(O)OP(=O)([O-])O |
|
AD12696 | -2.32 | 167.17 | C6H9ON5 | C[N+]1=C[N]C2=C1C(O)NC(N)=N2 |
|
AD12697 | 4.25 | 504.66 | C29H44O7 | CC1C(O)CC2CC(=O)C3(O)OC(CC3C)C(C)(C)C(C=CC=CC3CCCCC3)OC(=O)CC1O2 |
|
AD12698 | -1.1 | 314.34 | C14H22O6N2 | NC(=O)COC1OC(C(=O)NC2CCCCC2)=CC(O)C1O |
|
AD12699 | -0.3 | 142.05 | C2H7O5P | COCOP(=O)(O)O |
|
AD12700 | 1.72 | 284.34 | C15H18ON5 | CCNc1nc(C#CC(O)C2CCCC2)nc2c1N=C[N]2 |