Glycoside
GD048568
Name:
NoneFormula:
C13H20O7N2Smiles:
CC(=O)N1C[C@@H]2C[C@]2(NC(=O)C(=O)[C@H](O)[C@H](O)[C@@H](O)CO)C1Aglycone:
CC(=O)N1CC2CC2(N)C1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.77 |
| AlogP: | -3.63 | Num_rotatable_bonds: | 6 |
| MolWt: | 316.31 | Num_heavy_atoms: | 22 |
| TPSA: | 147.4 | NumAromaticRings: | 0 |
Unique Aglycone
AD25922
Formula: C7H12ON2
Smiles:
CC(=O)N1CC2CC2(N)C1| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.86 |
| AlogP: | -0.43 | Num_rotatable_bonds: | 0 |
| MolWt: | 140.19 | Num_heavy_atoms: | 10 |
| TPSA: | 46.33 | NumAromaticRings: | 0 |
