Glycoside
GD079473
Name:
NoneFormula:
C20H28O8N2Smiles:
COC(=O)[C@@H]1C[C@H](N[C@H]2[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)CCN1C(=O)c1ccccc1Aglycone:
COC(=O)C1CC(N)CCN1C(=O)c1ccccc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.6 |
| AlogP: | -1.78 | Num_rotatable_bonds: | 5 |
| MolWt: | 424.45 | Num_heavy_atoms: | 30 |
| TPSA: | 148.79 | NumAromaticRings: | 1 |
Unique Aglycone
AD36330
Formula: C14H18O3N2
Smiles:
COC(=O)C1CC(N)CCN1C(=O)c1ccccc1| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.43 |
| AlogP: | 0.79 | Num_rotatable_bonds: | 2 |
| MolWt: | 262.31 | Num_heavy_atoms: | 19 |
| TPSA: | 72.63 | NumAromaticRings: | 1 |
