aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD13581 | -2.08 | 1039.15 | C47H74O18N8 | O=C(CCCCO)NCC(=O)NCCCC(=O)OCC(COC(=O)CCCNC(=O)CNC(=O)CCCCO)(COC(=O)CCCNC(=O)CNC(=O)CCCCO)NC(=O)CNC(=O)OCc1ccccc1 |
|
AD13582 | 2.04 | 121.18 | C8H11N | CNc1ccc(C)cc1 |
|
AD13583 | 1.68 | 105.14 | C7H7N | N=Cc1ccccc1 |
|
AD13584 | -0.32 | 107.11 | C2H3O3S | C=CS(=O)(=O)[O-] |
|
AD13585 | 1.28 | 1018.91 | C32H53O21N4P3S3 | Cc1cn(C2CC(OCCOCCOCCOCCOCCOCCOP(=O)(S)OC3CC(n4cc(C)c(=O)[nH]c4=O)OC3COP(=O)(O)S)C(COP(=O)(O)S)O2)c(=O)[nH]c1=O |
|
AD13586 | 0.91 | 213.26 | C9H11O3NS | CNS(=O)(=O)C=Cc1ccccc1O |
|
AD13587 | -1.16 | 121.1 | C5H3ON3 | N#Cc1cc[nH+]nc1[O-] |
|
AD13588 | 0.61 | 195.22 | C10H13O3N | CNC(Cc1ccc(O)cc1)C(=O)O |
|
AD13589 | 4.74 | 431.44 | C25H21O6N | COc1cccc(-c2cc(C(=O)Nc3coc4c(C)c(O)ccc4c3=O)ccc2OC)c1 |
|
AD13590 | 1.75 | 239.21 | C12H7O2N4 | O=C(O)c1cccc(-c2ncnc3c2N=C[N]3)c1 |