Glycoside
GD081730
Name:
NoneFormula:
C17H28O10N2Smiles:
COC(=O)[C@@H]1C[C@@H](NC(=O)C(=O)[C@H](O)[C@H](O)[C@@H](O)CO)CN1C(=O)OC(C)(C)CAglycone:
COC(=O)C1CC(N)CN1C(=O)OC(C)(C)CSugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 12 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.76 |
| AlogP: | -2.7 | Num_rotatable_bonds: | 7 |
| MolWt: | 420.42 | Num_heavy_atoms: | 29 |
| TPSA: | 182.93 | NumAromaticRings: | 0 |
Unique Aglycone
AD36750
Formula: C11H20O4N2
Smiles:
COC(=O)C1CC(N)CN1C(=O)OC(C)(C)C| HBA: | 6 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.82 |
| AlogP: | 0.5 | Num_rotatable_bonds: | 1 |
| MolWt: | 244.29 | Num_heavy_atoms: | 17 |
| TPSA: | 81.86 | NumAromaticRings: | 0 |
