aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD08691 | 0.66 | 531.74 | C27H53O7N3 | CC1CC(N(C)C)C(O)C(OC2C(C)C(O)C(C)C(=O)OCCN(C)CC(C)C(N)C(C)CC2(C)O)O1 |
|
AD08692 | -0.33 | 186.24 | C6H10ON4S | CSc1nc(N)c(N)c(=O)n1C |
|
AD08693 | -0.59 | 538.62 | C24H34O3N12 | Cn1cc(-c2cc(C(=O)NCCCCC(=O)NC(CCCNC(=N)N)C(N)=O)cc(-c3cn(C)nn3)c2)nn1 |
|
AD08694 | 0.19 | 566.67 | C26H38O3N12 | Cn1cc(-c2cc(C(=O)NCCCCCCC(=O)NC(CCCNC(=N)N)C(N)=O)cc(-c3cn(C)nn3)c2)nn1 |
|
AD08695 | 2.1 | 176.24 | C9H8N2S | N#Cc1cc2c([nH]c1=S)CCC2 |
|
AD08696 | -0.93 | 402.19 | C10H16O11N2P2 | COP(=O)(O)OC1CC(n2ccc(=O)[nH]c2=O)OC1COP(=O)(O)O |
|
AD08697 | 5.08 | 474.73 | C30H50O4 | CC1(C)CC(O)C2(CO)C(O)CC3(C)C(=CCC4C5(C)CCC(O)C(C)(C)C5CCC43C)C2C1 |
|
AD08698 | 1.88 | 263.25 | C13H13O5N | CON=C(C)c1c(O)oc2c(C)c(O)ccc2c1=O |
|
AD08699 | -0.02 | 182.17 | C9H10O4 | COC(=O)CC1(O)C=CC(=O)C=C1 |
|
AD08700 | -0.11 | 168.15 | C8H8O4 | O=C1C=CC(O)(CC(=O)O)C=C1 |