Glycoside
GD065552
Name:
NoneFormula:
C15H22O6N2SSmiles:
O=C(CN1CCc2sccc2C1)N[C@H]1[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]1OAglycone:
NC(=O)CN1CCc2sccc2C1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.67 |
| AlogP: | -1.98 | Num_rotatable_bonds: | 4 |
| MolWt: | 358.42 | Num_heavy_atoms: | 24 |
| TPSA: | 122.49 | NumAromaticRings: | 1 |
Unique Aglycone
AD31524
Formula: C9H12ON2S
Smiles:
NC(=O)CN1CCc2sccc2C1| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.44 |
| AlogP: | 0.59 | Num_rotatable_bonds: | 2 |
| MolWt: | 196.27 | Num_heavy_atoms: | 13 |
| TPSA: | 46.33 | NumAromaticRings: | 1 |
