aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD20121 | -0.71 | 899.07 | C40H82O21 | OCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCO |
|
AD20122 | 1.34 | 588.56 | C29H32O13 | COc1cc(C2c3cc4c(cc3C(OC3OC5COC(C)OC5C(O)C3O)C3COC(=O)C23)OCO4)cc(OC)c1O |
|
AD20123 | 1.85 | 805.97 | C40H63O12N5 | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)Cc3ccc(-c4cn(CC(=O)NO)nn4)cc3)C2O)C(C)(OC)CC(C)C(=O)C(C)C(O)C1(C)O |
|
AD20124 | -0.96 | 239.3 | C7H17O4N3S | CCC(C)C(N)C(=O)NS(=O)(=O)N(C)O |
|
AD20125 | 2.87 | 780.06 | C42H73O10N3 | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)CN(CCCNC(=O)CCCc2ccccc2)C(C)C(O)C1(C)O |
|
AD20126 | 4.62 | 540.62 | C32H32O6N2 | O=C(NCCOCCOCCNC(=O)c1cccc(-c2ccc(O)cc2)c1)c1cccc(-c2ccc(O)cc2)c1 |
|
AD20127 | 3.87 | 609.63 | C27H49O10NP2 | CC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCOP(=O)(O)OP(=O)(O)CC1NC(CO)C(O)C(O)C1O |
|
AD20128 | 5.79 | 440.5 | C28H24O5 | COc1cc(O)c(C(=O)c2ccc(OCc3ccccc3)cc2)c(OCc2ccccc2)c1 |
|
AD20129 | 2.16 | 261.07 | C9H9O4Br | COc1cc(C(=O)O)cc(Br)c1OC |
|
AD20130 | 4.15 | 288.6 | C11H7NClSBr | Clc1ccc(Cc2scnc2Br)cc1 |