Glycoside
GD044192
Name:
NoneFormula:
C9H14O6N2SSmiles:
CCOc1nc(=O)n([C@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)s1Aglycone:
CCOc1nc(=O)[nH]s1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.78 |
| AlogP: | -1.68 | Num_rotatable_bonds: | 4 |
| MolWt: | 278.29 | Num_heavy_atoms: | 18 |
| TPSA: | 114.04 | NumAromaticRings: | 1 |
Unique Aglycone
AD24980
Formula: C4H6O2N2S
Smiles:
CCOc1nc(=O)[nH]s1| HBA: | 4 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.5 |
| AlogP: | 0.23 | Num_rotatable_bonds: | 2 |
| MolWt: | 146.17 | Num_heavy_atoms: | 9 |
| TPSA: | 54.98 | NumAromaticRings: | 1 |
