aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD05751 | -2.87 | 635.63 | C27H37O11N7 | O=CN(O)CCCC(NC(=O)C(CO)NC(=O)C1COC(c2ccccc2O)=N1)C(=O)NCCC(=O)NC1CCCN(O)C1=O |
|
AD05752 | 3.31 | 1207.55 | C60H110O20N4 | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)CCN(C)C3CC(C)OC(OC4C(C)C(O)C(C)C(=O)OC(CC)C(C)(O)C(O)C(C)C(=NO)C(C)CC4(C)OC)C3O)C2O)C(C)(OC)CC(C)C(=NO)C(C)C(O)C1(C)O |
|
AD05753 | 2.22 | 128.17 | C10H8 | C=CC#Cc1ccccc1 |
|
AD05754 | 5.38 | 486.69 | C30H46O5 | CC12CCC3(C)C(=CC(=O)C4C5(C)CCC(O)C(C)(C)C5CCC43C)C1CC(C)(C(=O)O)C(O)C2 |
|
AD05755 | 4.7 | 380.44 | C26H20O3 | COc1ccc2c(c1)C1(C=CC3C(O)c4cc5ccccc5cc4C31)C(=O)C=C2 |
|
AD05756 | 2.06 | 388.43 | C16H18O3N7S | CC(C)N(C)S(=O)(=O)c1ccc(NC(=O)Nc2ncnc3c2N=C[N]3)cc1 |
|
AD05757 | 2.14 | 1313.24 | C64H73O16N12Cl2 | CNC(CC(C)C)C(=O)NC1C(=O)NC(CC(N)=O)C(=O)NC2C(=O)NC3C(=O)NC(C(=O)NC(C(=O)NCCCN(C)C)c4cc(O)c(CNCCC[NH])c(O)c4-c4cc3ccc4O)C(O)c3ccc(c(Cl)c3)Oc3cc2cc(c3O)Oc2ccc(cc2Cl)C1O |
|
AD05758 | 1.02 | 152.18 | C5H4N4S | S=c1[nH]c2cncnc2[nH]1 |
|
AD05759 | 1.74 | 146.15 | C8H6ON2 | c1ccc(-c2nnco2)cc1 |
|
AD05760 | 4.07 | 221.3 | C16H15N | Cc1ccc2c(Cc3ccccc3)c[nH]c2c1 |