aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD20401 | 6.13 | 470.69 | C30H46O4 | CC1=C2C3=CCC4C5(C)CCC(O)C(C)(CO)C5CCC4(C)C3(C)CCC2(C(=O)O)CCC1C |
|
AD20402 | 1.59 | 272.29 | C13H14O2N5 | CCC(=O)Nc1cccc(C(=O)NCC2=C[N]N=N2)c1 |
|
AD20403 | -1.13 | 215.16 | C7H9O5N3 | O=C(O)CC(C(=O)O)n1cc(CO)nn1 |
|
AD20404 | -1.75 | 273.31 | C12H21O5N2 | CCN(CC(=O)NCCO)C(=O)CCCCC(=O)[O-] |
|
AD20405 | 1.88 | 276.29 | C15H16O5 | Cc1cc(=O)c2c(O)c3c(cc2o1)OC(C(C)(C)O)C3 |
|
AD20406 | 5.95 | 518.78 | C32H54O5 | COC(OC)C1(C)CCC23COC4(CCC5C6(C)CCC(O)C(C)(C)C6CCC5(C)C4(C)CC2O)C3C1 |
|
AD20407 | 2.8 | 218.17 | C10H9O2F3 | COC(=O)c1ccc(C)cc1C(F)(F)F |
|
AD20408 | 4.11 | 496.39 | C25H27O5N3Cl2 | O=C(O)NCC(=O)Nc1ccc(OC(=O)CCCc2ccc(N(CCCl)CCCl)cc2)cc1 |
|
AD20409 | 2.87 | 260.29 | C15H16O4 | Cc1c(O)ccc2oc(=O)c3c(c12)OC(C)C3(C)C |
|
AD20410 | 4.69 | 1350.73 | C68H123O23N3 | CC(C)CCCC(C)C1CCC2C3CC=C4CC(OC(=O)CNC(=O)CCCCC(=O)NCC(=O)NC(COCOCCOCCOCCOCCO)(COCOCCOCCOCCOCCO)COCOCCOCCOCCOCCO)CCC4(C)C3CCC12C |