aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD17001 | -33.98 | 4403.31 | C176H225O51N89 | Cc1cn(CC(=O)N(CCNC(=O)CN(CCNC(=O)CN(CCNC(=O)CN(CCNC(=O)CN(CCNC(=O)CN(CCNC(=O)CN(CCNC(=O)CN(CCNC(=O)CN(CCNC(=O)CN(CCNC(=O)CN(CCNC(=O)CN(CCNC(=O)CN(CCNC(=O)CN(CCNC(=O)CN(CCNC(=O)CN(CCNC(=O)CCCCCO)C(=O)Cn2cc(C)c(=O)[nH]c2=O)C(=O)Cn2ccc(N)nc2=O)C(=O)Cn2ccc(N)nc2=O)C(=O)Cn2ccc(N)nc2=O)C(=O)Cn2cnc3c(N)ncnc32)C(=O)Cn2cnc3c(=O)[nH]c(N)nc32)C(=O)Cn2cnc3c(=O)[nH]c(N)nc32)C(=O)Cn2ccc(N)nc2=O)C(=O)Cn2cc(C)c(=O)[nH]c2=O)C(=O)Cn2ccc(N)nc2=O)C(=O)Cn2cnc3c(N)ncnc32)C(=O)Cn2cnc3c(=O)[nH]c(N)nc32)C(=O)Cn2cnc3c(N)ncnc32)C(=O)Cn2cc(C)c(=O)[nH]c2=O)C(=O)Cn2ccc(N)nc2=O)CC(N)=O)c(=O)[nH]c1=O |
|
AD17002 | 5.18 | 488.71 | C30H48O5 | CC1(C)CCC2(C(=O)O)CCC3(C)C(=CCC4C5(C)CC(O)C(O)C(C)(C)C5C(O)CC43C)C2C1 |
|
AD17003 | -0.32 | 370.41 | C18H22O3N6 | Cc1cc2nc3c(=O)n(CC(=O)NCCCN)c(=O)nc-3n(C)c2cc1C |
|
AD17004 | 2.17 | 165.19 | C9H11O2N | COC(=O)Nc1ccccc1C |
|
AD17005 | 1.77 | 277.28 | C14H15O5N | COc1cc(-c2c(O)cc[nH]c2=O)cc(OC)c1OC |
|
AD17006 | -0.24 | 177.19 | C7H9N6 | NCCNc1ncnc2c1N=C[N]2 |
|
AD17007 | 0.99 | 271.3 | C13H15ON6 | CN1N=C(NC(=O)C(C)(C)C)C2=C[N]c3ncnc1c32 |
|
AD17008 | 1.59 | 269.29 | C13H13ON6 | COc1ccccc1CNc1nc(N)c2c(n1)[N]C=N2 |
|
AD17009 | 2.75 | 210.24 | C12H10N4 | C=Nc1n[nH]c2nc3cc(C)ccc3cc12 |
|
AD17010 | 4.44 | 457.55 | C24H27O6NS | CCCCCCCc1cc(O)c(C)c2oc(=O)c(C(=O)NS(=O)(=O)c3ccccc3)cc12 |