Glycoside
GD019876
Name:
NoneFormula:
C19H22O7N5SSmiles:
O=S(=O)([O-])c1ccc(CCCNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@H](O)[C@H]2O)cc1Aglycone:
O=S(=O)([O-])c1ccc(CCCNc2ncnc3c2N=C[N]3)cc1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.42 |
| AlogP: | -0.61 | Num_rotatable_bonds: | 8 |
| MolWt: | 464.48 | Num_heavy_atoms: | 32 |
| TPSA: | 182.75 | NumAromaticRings: | 3 |
Unique Aglycone
AD13805
Formula: C14H13O3N5S
Smiles:
O=S(=O)([O-])c1ccc(CCCNc2ncnc3c2N=C[N]3)cc1| HBA: | 8 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.21 |
| AlogP: | 1.33 | Num_rotatable_bonds: | 6 |
| MolWt: | 331.36 | Num_heavy_atoms: | 23 |
| TPSA: | 121.47 | NumAromaticRings: | 2 |
