Glycoside
GD055855
Name:
NoneFormula:
C15H19O6N2ClSmiles:
CC(C)(NC(=O)C(=O)[C@H](O)[C@@H](O)[C@@H](O)CO)c1cc(Cl)ccn1Aglycone:
CC(C)(N)c1cc(Cl)ccn1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 8 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | -1.27 | Num_rotatable_bonds: | 7 |
| MolWt: | 346.77 | Num_heavy_atoms: | 23 |
| TPSA: | 139.98 | NumAromaticRings: | 1 |
Unique Aglycone
AD28147
Formula: C9H11N2Cl
Smiles:
CC(C)(N)c1cc(Cl)ccn1| HBA: | 2 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.38 |
| AlogP: | 1.93 | Num_rotatable_bonds: | 1 |
| MolWt: | 170.64 | Num_heavy_atoms: | 11 |
| TPSA: | 38.91 | NumAromaticRings: | 1 |
