aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD20431 | 4.58 | 568.75 | C34H48O7 | CCC(C)C1OC2(C=CC1C)CC1CC(CC=C(C)C(O)C(C)C=CC=C3COC4C(O)C(C)=CC(C1=O)C34O)O2 |
|
AD20432 | 2.96 | 3017.84 | C138H190O32N24S10 | NC(=O)C(CSSCC(NC(=O)C(CCCCNC(=O)C(CCCCNC(=O)C(Cc1ccc(O)cc1)NC(=O)CCS)NC(=O)C(Cc1ccc(O)cc1)NC(=O)CCS)NC(=O)C(CCCCNC(=O)C(Cc1ccc(O)cc1)NC(=O)CCS)NC(=O)C(Cc1ccc(O)cc1)NC(=O)CCS)C(N)=O)NC(=O)C(CCCCNC(=O)C(CCCCNC(=O)C(Cc1ccc(O)cc1)NC(=O)CCS)NC(=O)C(Cc1ccc(O)cc1)NC(=O)CCS)NC(=O)C(CCCCNC(=O)C(Cc1ccc(O)cc1)NC(=O)CCS)NC(=O)C(Cc1ccc(O)cc1)NC(=O)CCS |
|
AD20433 | 2.92 | 597.82 | C29H51O6N5S | COC(=O)CCCCCNC(=O)CCCCCNC(=O)CCCCCNC(=O)CCCCC1SCC2NC(=O)NC21 |
|
AD20434 | 1.51 | 148.21 | C9H12N2 | c1cncc(C2CCCN2)c1 |
|
AD20435 | 2.21 | 184.24 | C12H12N2 | NCc1ccc(-c2cccnc2)cc1 |
|
AD20436 | 5.32 | 350.41 | C22H22O4 | CCCCOc1ccc(-c2c(O)cc(-c3ccccc3)c(O)c2O)cc1 |
|
AD20437 | 1.51 | 325.84 | C17H24O2N3Cl | CN(CCC(N)C(=O)O)CC1CN(Cc2ccccc2Cl)C1 |
|
AD20438 | 2.24 | 292.31 | C14H12O5S | COC(=O)c1ccc(S(=O)(=O)Oc2ccccc2)cc1 |
|
AD20439 | 8.49 | 1792.18 | C95H138O25N8 | CC(=O)OC1C(=O)C2(C)C(O)CC3OCC3(OC(C)=O)C2C(OC(=O)c2ccccc2)C2(O)CC(OC(=O)C(OC(=O)CCCc3cn(CCCCCCCCCCC(=O)NC(COCCC(=O)NCCCCCCO)(COCCC(=O)NCCCCCCO)COCCC(=O)NCCCCCCO)nn3)C(NC(=O)c3ccccc3)c3ccccc3)C(C)=C1C2(C)C |
|
AD20440 | 0.41 | 143.19 | C7H13O2N | CN1CCC(C(=O)O)CC1 |