natural glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD118392 | -1.26 | 1041.12 | C52H64O15N8 | CCc1c(OC)cc(OC2OC(O)(C(O)O)C(O)(CC(CN3C(=O)C=CC3=O)C3=CCNC(N)=C3)C(O)C2O)c2c1C(=O)c1c3c4c(c(O)c1C2=O)C(NC(=N)NC)CCC4C(C1=CNC(N)C=C1)C(CCO)CC3 |
|
GD118393 | 1.93 | 843.06 | C44H74O15 | CC(=O)OC1C(O)COC(OC2CCC3(C)C(C(OC4OC(CO)C(O)C(O)C4O)CC4C5(C)CC(O)C(C6(C)CCC(C(C)(C)O)O6)C5(C)CCC43C)C2(C)C)C1O |
|
GD118394 | 0.16 | 535.5 | C25H29O12N | OCC1OC(OC2Cc3c(O)cc(O)c(C4CCC(O)=N4)c3OC2c2ccc(O)c(O)c2)C(O)C(O)C1O |
|
GD118395 | -1.22 | 310.37 | C11H22O6N2S | CC(C)N=C(O)CC1OC(CNS(C)(=O)=O)C(O)C1O |
|
GD118396 | 2.71 | 764.99 | C42H68O12 | CC1OC(OC2C(OC3CC(O)C4(C)C(CCC5(C)C4C=CC4=C6CC(C)(C)CC(O)C6(C)CCC45C)C3(C)C)OC(CO)C(O)C2O)C(O)C(O)C1O |
|
GD118397 | -0.91 | 1127.02 | C53H58O27 | COc1cc(C=CC(=O)OCC2OC(OC3C(OC4=C(c5ccc(O)c(O)c5)[OH+][C]5C=C(O)C=C(OC6OC(CO)C(O)C(O)C6O)C5=C4)OC(COC(=O)C=Cc4ccc(O)c(OC)c4)C(O)C3O)C(O)C(O)C2O)ccc1O |
|
GD118398 | 0.72 | 802.93 | C38H58O16S | C=C1COC2(CC1O)OC1CC3C4CC=C5CC(O)CC(OC6OCC(OS(=O)(=O)O)C(O)C6OC6OC(C)C(O)C(O)C6O)C5(C)C4CCC3(C)C1C2C |
|
GD118399 | -2.34 | 438.47 | C19H34O11 | CC(C)CC(=O)C(C)OC1OC(COC2OC(C)C(O)C(O)C2O)C(O)C(O)C1O |
|
GD118400 | -0.14 | 1132.26 | C52H85O22N5 | CCCCCCCCCCCCC(CC(=O)OC1CN(C)C(C(OC2OC(CN)C(O)C2O)C2OC(n3ccc(O)nc3=O)C(O)C2O)C(=O)N(C)C1C(=O)O)OC(=O)CC(C)CC(=O)OC1OC(C)C(OC)C(OC)C1OC |
|
GD118401 | -1.21 | 756.84 | C37H56O16 | CC(=O)OC1CC2(O)C3CCC4CC(OC5OC(CO)C(OC6OC(CO)C(O)C(O)C6O)C(O)C5O)CCC4(C)C3CCC2(C)C1C1=CC(=O)OC1 |