aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD04291 | -1.68 | 1328.8 | C41H57O32N8P5 | COP(=O)(O)OC1CC(n2cc(C)c(=O)[nH]c2=O)OC1COP(=O)(O)OC1CC(n2cc(C)c(=O)[nH]c2=O)OC1COP(=O)(O)OC1CC(n2cc(C)c(=O)[nH]c2=O)OC1COP(=O)(O)OC1CC(n2cc(C)c(=O)[nH]c2=O)OC1COP(=O)(O)O |
|
AD04292 | 0.03 | 430.24 | C12H20O11N2P2 | COP(=O)(O)OCC1OC(n2cc(C)c(=O)[nH]c2=O)CC1OP(=O)(O)OC |
|
AD04293 | 2.62 | 948.07 | C47H69O17N3 | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(NC(=O)C(Cc3ccc(O)cc3)NC(=O)CCCOc3ccc([N+](=O)[O-])cc3OC)C2O)C(C)(O)CC(C)C(=O)C(C)C(O)C1(C)O |
|
AD04294 | -1.04 | 134.12 | C6H4ON3 | C#CC1=C[N]N=C1C(N)=O |
|
AD04295 | 5.11 | 360.25 | C18H9N4Cl2S | Clc1cc2nc3c(nc2cc1Cl)N=C(SCc1ccccc1)[N]3 |
|
AD04296 | 3.18 | 346.8 | C16H11O2N4ClS | Oc1ccc(Cl)cc1C=Nn1c(S)nnc1-c1ccccc1O |
|
AD04297 | 3.08 | 321.51 | C20H35O2N | CC12CCC(O)CC1CCC1C2CCC2(C)C(CN)CCC12O |
|
AD04298 | -0.35 | 204.23 | C7H16O3N4 | COCON=[N+]([O-])N1CCN(C)CC1 |
|
AD04299 | 1.55 | 290.27 | C15H14O6 | Oc1cc(O)c2c(c1)OC(c1ccc(O)c(O)c1)C(O)C2 |
|
AD04300 | 3.29 | 484.63 | C26H44O8 | CCC1CC2CC(O)C(C)(C)C(CC(=O)OC(CC)CC3CC(O)C(C)(C)C(CC(=O)O1)O3)O2 |