Glycoside
GD051437
Name:
NoneFormula:
C13H16O5N2SSmiles:
OC[C@H]1O[C@H](O)[C@H](Nc2cc3ccsc3cn2)[C@@H](O)[C@@H]1OAglycone:
Nc1cc2ccsc2cn1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.46 |
| AlogP: | -0.49 | Num_rotatable_bonds: | 3 |
| MolWt: | 312.35 | Num_heavy_atoms: | 21 |
| TPSA: | 115.07 | NumAromaticRings: | 2 |
Unique Aglycone
AD26892
Formula: C7H6N2S
Smiles:
Nc1cc2ccsc2cn1| HBA: | 2 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 1.88 | Num_rotatable_bonds: | 0 |
| MolWt: | 150.21 | Num_heavy_atoms: | 10 |
| TPSA: | 38.91 | NumAromaticRings: | 2 |
