Glycoside
GD049034
Name:
NoneFormula:
C13H20O7N2Smiles:
Cc1cc(C[C@H](C)NC(=O)C(=O)[C@H](O)[C@@H](O)[C@@H](O)CO)on1Aglycone:
Cc1cc(CC(C)N)on1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.62 |
| AlogP: | -2.33 | Num_rotatable_bonds: | 8 |
| MolWt: | 316.31 | Num_heavy_atoms: | 22 |
| TPSA: | 153.12 | NumAromaticRings: | 1 |
Unique Aglycone
AD26027
Formula: C7H12ON2
Smiles:
Cc1cc(CC(C)N)on1| HBA: | 3 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.57 |
| AlogP: | 0.87 | Num_rotatable_bonds: | 2 |
| MolWt: | 140.19 | Num_heavy_atoms: | 10 |
| TPSA: | 52.05 | NumAromaticRings: | 1 |
