Glycoside
GD096403
Name:
NoneFormula:
C19H28O5N6FSSmiles:
OC[C@H]1O[C@@H](n2cc(F)c3c(NC(=S)NCCC[NH+]4CCOCC4)ncnc32)[C@H](O)[C@@H]1OAglycone:
FC1=C[N]c2ncnc(NC(=S)NCCC[NH+]3CCOCC3)c21Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.63 |
| AlogP: | -2.23 | Num_rotatable_bonds: | 7 |
| MolWt: | 471.54 | Num_heavy_atoms: | 32 |
| TPSA: | 138.36 | NumAromaticRings: | 2 |
Unique Aglycone
AD40999
Formula: C14H19ON6FS
Smiles:
FC1=C[N]c2ncnc(NC(=S)NCCC[NH+]3CCOCC3)c21| HBA: | 7 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.5 |
| AlogP: | -0.41 | Num_rotatable_bonds: | 5 |
| MolWt: | 338.41 | Num_heavy_atoms: | 23 |
| TPSA: | 77.61 | NumAromaticRings: | 1 |
