aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD02591 | 0.12 | 126.05 | C2H7O4P | CCOP(=O)(O)O |
|
AD02592 | 3.3 | 186.29 | C11H22O2 | CCCCCCCCCC(=O)OC |
|
AD02593 | 2.62 | 262.29 | C13H10O4S | O=C(CC(=O)c1ccc(O)cc1O)c1cccs1 |
|
AD02594 | -1.06 | 2231.88 | C109H140O29N21Cl | CCCCC(CC)C(=O)NC(CC(N)=O)C(=O)NCC1C(=O)NC(c2ccc(O)cc2)C(=O)NC(CCCN)C(=O)NC(C(C)C)C(=O)NC(c2ccc(O)cc2)C(=O)NC(c2ccc(O)cc2)C(=O)NC(C(C)O)C(=O)NC(Cc2ccccc2)C(=O)NC(CCCN)C(=O)NC(c2ccc(O)cc2)C(=O)NC(C(C)O)C(=O)NC(c2ccc(O)cc2)C(=O)NCC(=O)NC(CC(C)C)C(=O)NC(C)C(=O)NC(c2ccc(O)c(Cl)c2)C(=O)OC1C(N)=O |
|
AD02595 | 9.65 | 686.87 | C32H64O9P2S | CCCCCCCCCCCCCCCCSCC(COP(=O)([O-])OP(=O)([O-])OC)OC(=O)CCCCCCCCCCC |
|
AD02596 | 0.43 | 444.47 | C20H26O5N7 | O=CNc1cc(C(O)CNCCOCCOCCNc2ncnc3c2N=C[N]3)ccc1O |
|
AD02597 | 3.94 | 529.35 | C26H17O4N4Br | O=C(NCC#Cc1cnc2c(c1)C(=C1C(=O)Nc3ccc(Br)cc31)C(=O)N2)OCc1ccccc1 |
|
AD02598 | 8.13 | 761.05 | C47H68O8 | CC(C)=CCCC(C)=CC(=O)OC1C(OC(=O)c2ccccc2)C2(CO)C(CC1(C)C)C1=CCC3C4(C)CCC(O)C(C)(C)C4CCC3(C)C1(C)C(O)C2O |
|
AD02599 | 4.8 | 432.65 | C27H44O4 | CCCCCC(=O)C(C)C1(O)C(O)CC2C3CC=C4CC(O)CCC4(C)C3CCC21C |
|
AD02600 | 1.22 | 604.83 | C31H60O9N2 | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)C(N(C)C)C(C)C(O)C1(C)O |