natural glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD115513 | 6.17 | 966.34 | C51H99O15N | CCCCCCCCCCCCCCCCCCC(O)C(O)=NC(COC1OC(CO)C(O)C(O)C1OC1OC(CO)C(O)C(O)C1O)C(O)C(O)CCCCCCCCCCCCCCC |
|
GD115514 | 3.01 | 586.72 | C30H50O11 | CCCCC(O)CC(CCCCCCCCCCC(=O)c1c(O)cc(O)cc1O)OC1OC(CO)C(O)C(O)C1O |
|
GD115515 | -1.13 | 444.41 | C18H20O11S | COC1=C(OC)C(=O)c2c(O)c(SC3OC(CO)C(O)C(O)C3O)cc(O)c2C1=O |
|
GD115516 | 3.01 | 875.09 | C42H70O15N2S | CCC1OC(=O)C=CC(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)CC(C)C(=O)CC(SCC(N=C(C)O)C(=O)O)C2OC2C1COC1OC(C)C(O)C(OC)C1OC |
|
GD115517 | 1.96 | 752.94 | C40H64O13 | CC1C(O)CC2(C(=O)O)CCC3(C)C(=CCC4C5(C)CCC(OC6OC(CO)C(O)C(O)C6OC6OC(CO)C(O)C6O)C(C)C5CCC43C)C2C1C |
|
GD115518 | 4.96 | 428.61 | C24H44O6 | CC(CCCCCCCCCCCCCC=CC(=O)O)OC1OC(C)C(O)CC1O |
|
GD115519 | -3.49 | 419.39 | C16H25O10N3 | N=c1ccn(C2CC(O)C(COCOC3OC(CO)C(O)C(O)C3O)O2)c(O)n1 |
|
GD115520 | 5.69 | 1072.02 | C41H68O18N7P3S | CCC=CCC=CCC=CCCCCCCCC(O)CC(=O)SCCN=C(O)CCN=C(O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O |
|
GD115521 | -1.06 | 1199.37 | C52H90O18N14 | COC1C(OC(C(NCCCN=C(O)C(N=C(O)C(NC(O)=NC(C(=O)O)C(C)C)C2CCNC(=N)N2)C(OC(=O)CCCCCCCCCCCCNC(=N)N)C(C)C)C(=O)O)C2OC(n3ccc(O)nc3=O)C(O)C2O)OC(CN)C1O |
|
GD115522 | -0.11 | 421.49 | C21H31O6N3 | Cc1ccc(C(=O)NCC2OC(CC(O)=NCCN3CCOCC3)C(O)C2O)cc1 |