Glycoside
GD054615
Name:
NoneFormula:
C13H20O7N2SSmiles:
CCS(=O)(=O)c1ccnc(N[C@H]2[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)c1Aglycone:
CCS(=O)(=O)c1ccnc(N)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.62 |
| AlogP: | -1.91 | Num_rotatable_bonds: | 5 |
| MolWt: | 348.38 | Num_heavy_atoms: | 23 |
| TPSA: | 149.21 | NumAromaticRings: | 1 |
Unique Aglycone
AD27831
Formula: C7H10O2N2S
Smiles:
CCS(=O)(=O)c1ccnc(N)c1| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.29 |
| AlogP: | 0.46 | Num_rotatable_bonds: | 2 |
| MolWt: | 186.24 | Num_heavy_atoms: | 12 |
| TPSA: | 73.05 | NumAromaticRings: | 1 |
