Glycoside
GD070217
Name:
NoneFormula:
C16H20O6N2SSmiles:
Cc1oncc1Nc1ccc(S[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)cc1Aglycone:
Cc1oncc1Nc1ccc(S)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.44 |
| AlogP: | 0.62 | Num_rotatable_bonds: | 5 |
| MolWt: | 368.41 | Num_heavy_atoms: | 25 |
| TPSA: | 128.21 | NumAromaticRings: | 2 |
Unique Aglycone
AD33255
Formula: C10H10ON2S
Smiles:
Cc1oncc1Nc1ccc(S)cc1| HBA: | 3 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.1 |
| AlogP: | 3.02 | Num_rotatable_bonds: | 2 |
| MolWt: | 206.27 | Num_heavy_atoms: | 14 |
| TPSA: | 38.06 | NumAromaticRings: | 2 |
