aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD00911 | 2.39 | 203.35 | C10H21ONS | CCCCCCCCNC(=O)CS |
|
AD00912 | 9.16 | 1481.6 | C78H101O16N10Cl2 | CCCCCCCCCCCCCCCCCC[N+](C)(C)CCCNC(=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 |
|
AD00913 | 1.88 | 121.12 | C6H5ON2 | N#[N+]c1ccc(O)cc1 |
|
AD00914 | 3.9 | 488.62 | C28H40O7 | CC=C(C)C(=O)OC1C2C3(C)CCC(O)CC3CCC23OC32CCC(C(C)=O)C2(C)C1OC(C)=O |
|
AD00915 | 4.07 | 259.35 | C19H17N | c1ccc2c(c1)CCNC2c1ccc2ccccc2c1 |
|
AD00916 | 2.98 | 318.77 | C14H9ON5ClS | CC(=O)c1cc(Cl)ccc1Sc1nc(N)nc2c1N=C[N]2 |
|
AD00917 | 3.94 | 248.5 | C12H4ONCl3 | O=Cc1c(Cl)[nH]c2cc(Cl)c(Cl)cc12 |
|
AD00918 | 2.34 | 622.59 | C34H26O10N2 | C=C1Oc2cc(OC)cc(C(=O)OC3COC(=O)CC(N)c4ccc(c(O)c4)OC4C#CC=C3C#CC3=CC=CC34O)c2NC1=O |
|
AD00919 | 3.96 | 612.76 | C34H48O8N2 | CCC(=O)OC1CC(=O)OC(CC=Cc2cnc3ccccc3c2)CCCN(C)CC(O)C(C)CC(CC=O)C(O)C1OC |
|
AD00920 | 0.04 | 218.25 | C10H18O5 | CCOC(=O)C1C(C)OC(O)CC1(C)O |