Glycoside
GD017477
Name:
NoneFormula:
C11H13O5N5SSmiles:
NC(=S)c1nn(C2O[C@H](CO)[C@H](O)[C@H]2O)c2nc[nH]c(=O)c12Aglycone:
NC(=S)C1=N[N]c2nc[nH]c(=O)c21Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.45 |
| AlogP: | -2.63 | Num_rotatable_bonds: | 3 |
| MolWt: | 327.32 | Num_heavy_atoms: | 22 |
| TPSA: | 159.51 | NumAromaticRings: | 2 |
Unique Aglycone
AD12463
Formula: C6H4ON5S
Smiles:
NC(=S)C1=N[N]c2nc[nH]c(=O)c21| HBA: | 6 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | -0.99 | Num_rotatable_bonds: | 1 |
| MolWt: | 194.2 | Num_heavy_atoms: | 13 |
| TPSA: | 98.23 | NumAromaticRings: | 1 |
