aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD09921 | 0.19 | 309.04 | C4H10O9NP3 | C#CCNP(=O)(O)OP(=O)(O)OP(=O)(O)OC |
|
AD09922 | -2.45 | 1167.39 | C49H68O11N17S3 | Cc1c(N)nc(C(CC(N)=O)NCC(N)C(N)=O)nc1C(=O)NC(C(=O)NC(C)C(O)C(C)C(=O)NC(C(=O)NCCc1nc(-c2nc(C(=O)NCCC[S+](C)CC(=O)Nc3ccccc3)cs2)cs1)C(C)O)C(O)c1c[nH]cn1 |
|
AD09923 | 4.39 | 280.76 | C18H13N2Cl | Clc1ccccc1Cc1ccc(-c2ccccc2)nn1 |
|
AD09924 | -1.47 | 292.28 | C11H14O3N7 | NC(=O)NCCCNC(=O)C1=C[N]c2nc(N)nc(O)c21 |
|
AD09925 | 3.54 | 800.78 | C39H40O13N6 | CC(C)CC(N)C(=O)NC1Cc2ccc(c([N+](=O)[O-])c2)Oc2cc(cc(Oc3ccc([N+](=O)[O-])cc3)c2O)C(C(O)C(=O)O)NC(=O)C(Cc2ccccc2)NC1=O |
|
AD09926 | 5.06 | 569.78 | C34H51O6N | CC1OC(OC2CCCC(C3CCC3)OC(=O)CC3C(=CC4C3C=CC3CC(O)CC34)C(=O)C2C)CCC1N(C)C |
|
AD09927 | 0.05 | 1440.02 | C46H66O30N11P5S | COP(=O)(O)OC1CC(n2cc(C)c(=O)[nH]c2=O)OC1COP(=O)(O)OC1CC(CCn2cnc3c(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)O |
|
AD09928 | 0.47 | 674.59 | C21H22O19S3 | O=c1c(O)c(-c2ccc(OCCOS(=O)(=O)O)c(OCCOS(=O)(=O)O)c2)oc2cc(OCCOS(=O)(=O)O)cc(O)c12 |
|
AD09929 | 0.99 | 206.24 | C11H14O2N2 | CCCCCC#Cc1c[nH]c(=O)[nH]c1=O |
|
AD09930 | 4.12 | 411.63 | C23H45O3N3 | CCCCCCCCCCCCCCCCNC(=O)C1COC(CN)N1C(C)=O |