aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD21761 | -11.77 | 3019.42 | C132H216O46N32S | CCC(C)C(NC(=O)C(CO)NC(=O)C(CCC(=O)O)NC(=O)C(CC(C)C)NC(=O)C(CCC(N)=O)NC(=O)C(CCC(=O)O)NC(=O)C(CC(C)C)NC(=O)CNC(=O)C(CO)NC(=O)C(NC(=O)C(CCC(=O)O)NC(=O)C(N)CC(=O)O)C(C)C)C(=O)NC(C(=O)NC(CC(N)=O)C(=O)NC(Cc1ccccc1)C(=O)NC(CCC(=O)O)C(=O)NC(CCCCN)C(=O)NC(CC(C)C)C(=O)NC(C)C(=O)NC(C)C(=O)NC(C)C(=O)NC(C)C(=O)NC(C)C(=O)NC(CCCCN)C(=O)NC(=O)CCSC1CC(=O)N(CCCC(=O)NCCOCCOCCOCC(=O)NC)C1=O)C(C)CC |
|
AD21762 | 1.95 | 128.22 | C8H16O | OCCC1CCCCC1 |
|
AD21763 | -0.12 | 144.17 | C6H12O2N2 | C=NC(CCCN)C(=O)O |
|
AD21764 | 1.87 | 249.26 | C13H9N6 | N#Cc1ccc(CNc2ncnc3c2N=C[N]3)cc1 |
|
AD21765 | -1.82 | 228.2 | C9H12O5N2 | O=c1ccn(C2OC(CO)CC2O)c(=O)[nH]1 |
|
AD21766 | 4.13 | 318.33 | C20H14O4 | O=C(Oc1ccccc1OC(=O)c1ccccc1)c1ccccc1 |
|
AD21767 | 3.96 | 211.29 | C13H9NS | c1ccc2cc(-c3nccs3)ccc2c1 |
|
AD21768 | 1.19 | 274.29 | C11H8O2N5S | O=S(=O)(Nc1ncnc2c1N=C[N]2)c1ccccc1 |
|
AD21769 | 3.4 | 591.67 | C29H30O4N7FS | O=C(CCn1cc(CN2CCN(c3cc4c(cc3F)c(=O)c(C(=O)O)cn4C3CC3)CC2)nn1)Nc1ccc(S)cc1 |
|
AD21770 | 3.84 | 619.72 | C31H34O4N7FS | O=C(CCCn1cc(CCN2CCN(c3cc4c(cc3F)c(=O)c(C(=O)O)cn4C3CC3)CC2)nn1)Nc1ccc(S)cc1 |