aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD01121 | 1.68 | 562.7 | C28H50O11 | CCCCCC1CCCCCCCCCC(=O)OC2C(OC(C)C(O)C2O)OC2C(O1)OC(CO)C(O)C2O |
|
AD01122 | 0.26 | 166.19 | C5H4N5S | Nc1nc(S)c2c(n1)[N]C=N2 |
|
AD01123 | 2.87 | 185.31 | C11H23ON | CCCCCCCCCCNC=O |
|
AD01124 | 3.85 | 355.35 | C18H17O5N3 | COc1ccc(NC(=O)Nc2cccc(C=CC(C)=O)c2)c([N+](=O)[O-])c1 |
|
AD01125 | 0.6 | 492.51 | C21H24O8N4S | CC1(C)OC2C(COC(=O)CCC(=O)Nc3ccc(S)nc3)OC(n3ccc(=O)[nH]c3=O)C2O1 |
|
AD01126 | -6.58 | 805.91 | C32H55O13N9S | NC(=O)CN(CCO)C(=O)CN(CCO)C(=O)CN(CCO)C(=O)CN(CCO)C(=O)CN(CCO)C(=O)CNC(=O)CCCCC1SCC2NC(=O)NC21 |
|
AD01127 | 0.2 | 124.12 | C6H6O2N | O=C(O)c1ccc[nH+]c1 |
|
AD01128 | 3.84 | 354.54 | C20H38O3N2 | CCCCCCCCCCCCCC(=O)OC1CCC(N)C(=O)NC1 |
|
AD01129 | 7.84 | 566.72 | C30H51O6N2P | CCCCCCCCCCCCCCCCOP(=O)(OCCO)Oc1ccc2[nH]cc(CCNC(C)=O)c2c1 |
|
AD01130 | 2.05 | 272.39 | C14H28O3N2 | CCCCCCCCCCC(N)C(=O)NCC(=O)O |