aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD18221 | -0.81 | 165.16 | C6H7ON5 | Cn1c(N)c2ncnc-2[nH]c1=O |
|
AD18222 | 6.09 | 755.7 | C31H35O13NP2S2 | COP(=O)(S)OCC(O)COP(=O)(S)OCCCCCCNC(=O)c1ccc2c(c1)C1(OC2=O)c2ccc(O)cc2Oc2cc(O)ccc21 |
|
AD18223 | 2.98 | 334.46 | C20H30O4 | CC1(C(=O)O)CCCC2(C)C1CC(O)C13C=C(CO)C(CCC21)C3 |
|
AD18224 | 3.68 | 843.12 | C45H74O9N6 | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)CN(CCCCc2cn(CCc3c[nH]c4ccccc34)nn2)C(C)C(O)C1(C)O |
|
AD18225 | 1.89 | 253.29 | C13H13N6 | Cc1ccc(CNc2nc(N)c3c(n2)[N]C=N3)cc1 |
|
AD18226 | 2.9 | 841.12 | C42H72O11N4S | CCOC(=O)c1ccc(NC(=S)NCCCN2CC(C)CC(C)(O)C(OC3OC(C)CC(N(C)C)C3O)C(C)C(O)C(C)C(=O)OC(CC)C(C)(O)C(O)C2C)cc1 |
|
AD18227 | -0.29 | 196.22 | C6H6ON5S | C[S+]([O-])c1nc(N)c2c(n1)[N]C=N2 |
|
AD18228 | 1.64 | 319.36 | C17H21O5N | Cc1c(O)ccc2c(OCCN3CCCC3CO)cc(=O)oc12 |
|
AD18229 | 1.96 | 268.35 | C15H24O4 | CC1CC2OC(=O)C(C)C2CC2(C)C(O)OCCC12 |
|
AD18230 | -5.73 | 1020.16 | C45H73O14N13 | CCC(C)C(NC(C)=O)C(=O)NC(C)C(=O)NC(C)CNCC(=O)NCC(=O)NC(Cc1ccccc1)C(=O)NC(CCC(O)CN)C(=O)NCC(=O)NC(CCC(=O)O)C(=O)NC(CCC(N)=O)C(N)=O |