aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD04831 | -2.22 | 176.22 | C7H16O3N2 | COC1C(N)CC(N)C(O)C1O |
|
AD04832 | 0.5 | 419.43 | C21H25O8N | CN=C(C(O)C(C)O)C(OC)C1Cc2cc3cc(O)cc(O)c3c(O)c2C(=O)C1O |
|
AD04833 | -0.14 | 881.85 | C30H53O17N5P2S2 | CCCC(=CCCSCC(NC(=O)CCC(N)C(=O)O)C(=O)NCC(=O)O)C(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OC |
|
AD04834 | 10.91 | 688.89 | C32H66O9P2S | CCCCCCCCCCCCCCSCC(COP(=O)(O)OP(=O)(O)OC)OC(=O)CCCCCCCCCCCCC |
|
AD04835 | 5.15 | 258.77 | C16H11ClS | Clc1ccccc1Cc1cc2ccccc2s1 |
|
AD04836 | -0.59 | 395.35 | C17H22O6N3P | CC(C)CC(NP(=O)([O-])O)C(=O)NC(Cc1c[nH]c2ccccc12)C(=O)[O-] |
|
AD04837 | 0.97 | 225.18 | C7H16O5NP | COP(=O)(O)NCCCCCC(=O)O |
|
AD04838 | -0.06 | 117.11 | C3H7O2N3 | CNC(=O)N(C)N=O |
|
AD04839 | 0.8 | 153.18 | C8H11O2N | OCCNc1cccc(O)c1 |
|
AD04840 | 0.69 | 205.24 | C9H13N6 | CCCCNC1=Nc2c(N)ncnc2[N]1 |