aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD03691 | 4.06 | 486.65 | C29H42O6 | C=C(C)CCC(O)C(C)(O)C1C(O)CC2(C)C3CCc4c(cc(O)c(O)c4C)C3(C)C(=O)CC12C |
|
AD03692 | 1.41 | 398.46 | C4H11O12P4Cl | COP(=O)(O)OP(=O)(O)C(Cl)P(=O)(O)OP(=O)(O)OC |
|
AD03693 | 3.99 | 946.32 | C50H95O13N3 | CCCCC1C(=O)OC(C(C)C(O)CCCNC(=N)N)C(C)C=C(C)CCCCC(O)CC(O)CC(O)CC(O)CC(O)C(O)C=C(C)C(O)CCCC(O)CCCC(O)CCC(C)C1O |
|
AD03694 | 0.77 | 358.39 | C19H22O5N2 | O=C1C2CCC3C(=NO)CC(O)C(O)C3C2C(=O)N1Cc1ccccc1 |
|
AD03695 | -0.17 | 420.36 | C15H25O8N4P | Nc1ccn(C2OC(COP(=O)(O)NCCCCCC(=O)O)CC2O)c(=O)n1 |
|
AD03696 | -0.02 | 1249.29 | C52H69O12N10S3I | CC(O)C(CO)NC(=O)C1CSSCC(NC(=O)C(Cc2ccccc2)NC(=O)CCS)C(=O)NC(Cc2ccc(O)c(I)c2)C(=O)NC(Cc2c[nH]c3ccccc23)C(=O)NC(CCCCN)C(=O)NC(C(C)O)C(=O)N1 |
|
AD03697 | 5.93 | 622.76 | C29H51O10PS | CC(=O)OC1CC2C3CC(OP(=O)(O)O)C4CC(OS(=O)(=O)O)CCC4(C)C3CCC2(C)C1C(C)CCCC(C)C |
|
AD03698 | 1.87 | 240.21 | C14H8O4 | O=C1c2cccc(O)c2C(=O)c2c(O)cccc21 |
|
AD03699 | 4.74 | 360.54 | C23H36O3 | C=CC1CCC2C3CCC4CC(O)CCC4(COC(C)=O)C3CCC12C |
|
AD03700 | 4.03 | 228.72 | C16H13Cl | Clc1ccccc1Cc1ccc2c(c1)CC2 |