natural glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD116982 | 2.39 | 836.85 | C44H44O13N4 | COc1ccc2c3c1OCCC#CC(c1ccccc1)C1Oc4cc(OC5OC(C(OC(=O)CC(=O)O)C(N)N)C(O)C(O)C5O)cc(Cn5cc6cc[nH]c6c5)c4C(O3)C21 |
|
GD116983 | -2.26 | 1457.55 | C59H92O35S3 | COC1C(O)C(COS(=O)(=O)O)OC(OC2C(O)C(COS(=O)(=O)O)OC(OC3C(C)OC(OC4C(OC5CCC6(C)C7CCC89C(=O)OC(C)(CCC=C(C)C)C8C(=O)CC9(C)C7=CCC6C5(C)C)OCC(OS(=O)(=O)O)C4O)C(OC4OCC(O)C(O)C4O)C3O)C2O)C1O |
|
GD116984 | -0.25 | 463.4 | C21H21O11N | N#CC(OC1OC(CO)C(O)C(O)C1OC(=O)c1cc(O)c(O)c(O)c1)c1ccc(O)cc1 |
|
GD116985 | 1.96 | 680.83 | C36H56O12 | COC1CC(OC2CCC3(C)C(CCC4C3CCC3(C)C(C5=CC(=O)OC5)CCC43O)C2)OC(C)C1OC1OC(CO)C(O)C(O)C1O |
|
GD116986 | -2.12 | 624.55 | C28H32O16 | COc1cc(O)c2c(=O)cc(-c3ccc(OC4OC(COC5OC(C(O)CO)C(O)C5O)C(O)C(O)C4O)c(O)c3)oc2c1 |
|
GD116987 | 6.99 | 865.24 | C47H92O13 | CCCCCCCCCCCCCCCCOCC(COC1OC(COC2OC(CO)C(O)C(O)C2O)C(O)C(O)C1O)OCCCCCCCCCCCCCCCC |
|
GD116988 | 0.78 | 528.47 | C26H24O12 | O=C(OCC1OC(Oc2cc(O)cc(O)c2C(=O)c2ccc(O)cc2)C(O)C(O)C1O)c1ccc(O)cc1 |
|
GD116989 | -5.26 | 978.1 | C43H75O18N7 | CC(N)C(O)=NC1C(OC2C(CO)OC(OC3C(O)COC(OC4C(CO)OC(Oc5ccc(C(=O)NCCCNCCCCNCCCCN)cc5)C4O)C3O)C(O)C2O)OC(C)C(N)C1O |
|
GD116990 | -2.36 | 506.5 | C22H34O13 | CC=C(C)C(=O)OC1C(OC2OC(CO)C(O)C(OC(=O)C(C)=CC)C2O)OC(CO)C(O)C1O |
|
GD116991 | 10.34 | 782.2 | C46H87O8N | CCCCCCCCC=CCCCCCCCCCCCCC(O)=NC(COC1OC(CO)C(O)C(O)C1O)C(O)C=CCCCCCCCCCCCC |