aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD15941 | 2.26 | 205.32 | C9H19O2NS | CSCCCNC(=O)OC(C)(C)C |
|
AD15942 | 2.24 | 289.32 | C16H13N6 | Nc1ncnc2c1N=C(NCc1cccc3ccccc13)[N]2 |
|
AD15943 | 3.87 | 301.82 | C19H20ONCl | CN1CC(COc2ccc(Cc3ccccc3Cl)cc2)C1 |
|
AD15944 | -0.92 | 2020.35 | C64H88O44N15P7S | COP(=O)(O)OC1CC(n2cc(C)c(=O)[nH]c2=O)OC1COP(=O)(O)OC1CC(n2cc(C)c(=O)[nH]c2=O)OC1COP(=O)(O)OC1CC(n2cnc3c(CCSC)nc(N)nc32)OC1COP(=O)(O)OC1CC(n2cc(C)c(=O)[nH]c2=O)OC1COP(=O)(O)OC1CC(n2cc(C)c(=O)[nH]c2=O)OC1COP(=O)(O)OC1CC(n2cc(C)c(=O)[nH]c2=O)OC1COP(=O)(O)O |
|
AD15945 | 3.63 | 596.77 | C26H53O7N4PS | CCCCCCCCNC(=O)NCCCCC(NC(=O)CCCOP(O)(=S)OC)C(=O)NCCCCCCO |
|
AD15946 | 1.43 | 132.16 | C6H12O3 | COC(=O)OCC(C)C |
|
AD15947 | 3.93 | 266.34 | C18H18O2 | c1ccc(C2CC2)c(Cc2ccc3c(c2)OCCO3)c1 |
|
AD15948 | -10.04 | 2198.57 | C98H160O24N34 | CCC(C)C(NC(=O)C1CCCN1C(=O)C(CCCNC(=N)N)NC(=O)C1CCCN1C(=O)C(Cc1cnc[nH]1)NC(=O)C(CO)NC(=O)C(NC(=O)C1CCCN1C(=O)C(CCCNC(=N)N)NC(=O)C1CCCN1C(=O)C(CO)NC(=O)C(Cc1ccc(O)cc1)NC(=O)C1CCCN1C(=O)C(CCCNC(=N)N)NC(=O)C1CCCN1C(=O)C(CCCCN)NC(=O)CN)C(C)O)C(=O)NC(CCCNC(=N)N)C(=O)NC(C(=O)O)C(C)C |
|
AD15949 | 3.51 | 591.74 | C32H49O9N | CCC(=O)OC1CC(=O)OCCCN(CCCCc2ccccc2)CC(OC(C)=O)C(C)CC(CC=O)C(O)C1OC |
|
AD15950 | 1.99 | 302.24 | C15H10O7 | O=c1cc(-c2cc(O)c(O)c(O)c2)oc2cc(O)cc(O)c12 |