aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD24111 | 0.61 | 520.41 | C17H34O12N2P2 | CCOC(=O)CCCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OC |
|
AD24112 | 0.08 | 468.36 | C12H26O11N2P2S | COP(=O)(O)OP(=O)(O)OCC(C)(C)C(O)C(=O)NCCC(=O)NCCSO |
|
AD24113 | -1.04 | 595.55 | C19H39O12N3P2S | COP(=O)(O)OP(=O)([O-])OCC(C)(C)C(O)C(=O)NCCC(=O)NCCSC(=O)CC(O)C[N+](C)(C)C |
|
AD24114 | -0.4 | 440.26 | C10H18O13P2S | COP(=O)(O)OP(=O)(O)OCC1OC2SC(O)(CCC(=O)O)OC2C1O |
|
AD24115 | -1.23 | 112.11 | C4H6ON3 | Nc1cc[nH+]c(=O)[nH]1 |
|
AD24116 | 4.43 | 510.76 | C30H54O6 | CCCC(C)C1CCC2C3C(OCCO)CC4CC(OCCO)CCC4(C)C3CC(OCCO)C12C |
|
AD24117 | 1.41 | 199.29 | C11H21O2N | CN(CCO)C(=O)CC1CCCCC1 |
|
AD24118 | 2.31 | 500.46 | C28H20O9 | COc1cc(C)c2ccc(O)c(C(=O)OC3C=C4C#CC5(C6COC(=O)O6)OC5C#CC=C4C3O)c2c1 |
|
AD24119 | -0.71 | 612.48 | C18H34O15N2P2S | COP(=O)(O)OP(=O)(O)OCC(C)(C)C(O)C(=O)NCCC(=O)NCCSCCC(O)(CC(=O)O)C(=O)O |
|
AD24120 | 12.46 | 648.11 | C42H81O3N | CCCCCCCCC=CCCCCCCCCCCCCCC(=O)NC(CO)C(O)C=CCCCCCCCCCCCCC |