aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD03811 | -7.13 | 1096.32 | C43H85O9N25 | N=C(N)NCCCC(NC(=O)C(CCCNC(=N)N)NC(=O)C(CCCNC(=N)N)NC(=O)C(CCCNC(=N)N)NC(=O)C(CCCNC(=N)N)NC(=O)C(CCCNC(=N)N)NC(=O)CCCCCNC=O)C(=O)O |
|
AD03812 | -3.25 | 322.31 | C12H22O8N2 | COC1(C(=O)O)CC(N)C(NC(C)=O)C(C(O)C(O)CO)O1 |
|
AD03813 | 1.02 | 191.3 | C8H17O2NS | CSCCC(N)C(=O)OC(C)C |
|
AD03814 | -0.39 | 306.06 | C7H7O2N4I | N#CNC(CI)c1c[nH]c(=O)[nH]c1=O |
|
AD03815 | 5.57 | 1283.23 | C65H73O16N9Cl2 | CCCCCCCCCCNC(=O)C1NC(=O)C2NC(=O)C(NC(=O)C3NC(=O)C(CC(N)=O)NC(=O)C(NC(=O)C(CC(C)C)NC)C(O)c4ccc(c(Cl)c4)Oc4cc3cc(c4O)Oc3ccc(cc3Cl)C2O)c2ccc(O)c(c2)-c2c(O)cc(O)cc21 |
|
AD03816 | 11.28 | 742.91 | C36H72O11P2 | CCCCCCCCCCCCCCCC(=O)OCC(COP(=O)(O)OP(=O)(O)OC)OC(=O)CCCCCCCCCCCCCCC |
|
AD03817 | 9.65 | 721.03 | C42H72O9 | CCCCCCC(CCCC(OC(C)=O)C1CCC(C2CCC(C(CCCCCCCCCCCCC3=CC(C)OC3=O)OC(C)=O)O2)O1)OC |
|
AD03818 | 2.33 | 104.15 | C8H8 | C=Cc1ccccc1 |
|
AD03819 | 3.8 | 554.68 | C31H42O7N2 | CCC1OC(=O)CC(O)C(C)C(O)C(CCOc2ncnc3ccccc23)CC(C)C(=O)C=CC(C)=CC1CO |
|
AD03820 | 6.91 | 456.71 | C30H48O3 | CC=CC1CC(C2CCC3(C)C4=CCC5C(C)(C)C(O)CCC5(C)C4CCC23C)C(OC)O1 |