aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD12021 | 1.55 | 643.86 | C33H61O9N3 | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)C(NCCCC#N)C(C)C(O)C1(C)O |
|
AD12022 | 1.59 | 238.66 | C10H9ON5Cl | Clc1nc2c(c(NC3CCCO3)n1)N=C[N]2 |
|
AD12023 | 2.82 | 316.31 | C17H16O6 | COc1cc(O)c2c(c1OC)OC(c1ccccc1O)CC2=O |
|
AD12024 | 0.03 | 255.98 | CH7O9P3 | CP(=O)(O)OP(=O)(O)OP(=O)(O)O |
|
AD12025 | 3.32 | 680.92 | C37H64O9N2 | COC1(C)CC(C)C(O)C(C)CN(C)CC(CCOCc2ccccc2)OC(=O)C(C)C(O)C(C)C1OC1OC(C)CC(N(C)C)C1O |
|
AD12026 | 4.46 | 728.97 | C41H64O9N2 | COC1(C)CC(C)C(O)C(C)CN(C)CC(COc2ccccc2-c2ccccc2)OC(=O)C(C)C(O)C(C)C1OC1OC(C)CC(N(C)C)C1O |
|
AD12027 | 3.19 | 383.36 | C19H17O6N3 | COC(=O)Nc1nc2cc(C(=O)c3ccccc3)ccc2n1COC(=O)OC |
|
AD12028 | 2.23 | 473.39 | C25H15O9N | COC1=CC(=O)c2c(O)c3c(c(O)c2C1=O)C(=O)C1(CCc2cc4ccnc(O)c4c(O)c21)C3=O |
|
AD12029 | -2.43 | 488.49 | C21H32O11N2 | COc1cc(CNCC(O)C(O)C2OC(OC)(C(=O)O)CC(O)C2NC(=O)CO)cc(OC)c1 |
|
AD12030 | 1.76 | 211.2 | C11H7ON4 | Oc1nc(-c2ccccc2)nc2c1N=C[N]2 |