aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD12911 | 2.07 | 248.32 | C15H20O3 | C=C1CCC2C(C)C(=O)OC2C2C(=C)C(O)CC12 |
|
AD12912 | 1.12 | 266.34 | C15H22O4 | C=C1CC(O)C2C(C)C(=O)OC2C2C1CC(O)C2C |
|
AD12913 | -0.49 | 191.18 | C7H13O5N | CC1OC(O)CC(C)([N+](=O)[O-])C1O |
|
AD12914 | 2.45 | 308.31 | C14H12O6S | O=S(=O)(O)Oc1ccc(C=Cc2cc(O)cc(O)c2)cc1 |
|
AD12915 | 2.81 | 698.99 | C39H66O5N6 | NCC1OC(OC2C(N)CC(N)C(O)C2OCCCCCCCCCCCCN2CCN(Cc3cccc4ccccc34)CC2)C(N)CC1O |
|
AD12916 | 6.05 | 424.62 | C25H44O5 | C=CCCCCCCCCC(=O)OCC(CO)OC(=O)CCCCCCCCC=C |
|
AD12917 | 1.69 | 181.61 | C8H6N4Cl | CNc1nc(Cl)cc2c1N=C[N]2 |
|
AD12918 | 1.52 | 291.3 | C14H11N8 | Cc1cccc(-c2cn(-c3nc(N)c4c(n3)[N]C=N4)nn2)c1 |
|
AD12919 | 2.51 | 631.77 | C33H49O9N3 | COC1C=CC=C(C)C(=O)NC2=CC(=O)C(NCCCCCO)=C(CC(C)CC(OC)C(O)C(C)C=C(C)C1OC(N)=O)C2=O |
|
AD12920 | 0.85 | 172.27 | C9H20ON2 | CCCNC(=O)CCCN(C)C |