Glycoside
GD081819
Name:
NoneFormula:
C17H21O8N2ClSmiles:
COC(=O)CCN(C(=O)C(=O)[C@H](O)[C@@H](O)[C@@H](O)CO)c1cc(Cl)ccc1NAglycone:
COC(=O)CCNc1cc(Cl)ccc1NSugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 1 |
| HBD: | 6 | FractionCSP3: | 0.44 |
| AlogP: | -1.54 | Num_rotatable_bonds: | 9 |
| MolWt: | 404.8 | Num_heavy_atoms: | 27 |
| TPSA: | 170.62 | NumAromaticRings: | 1 |
Unique Aglycone
AD36774
Formula: C11H13O2N2Cl
Smiles:
COC(=O)CCNc1cc(Cl)ccc1N| HBA: | 4 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.3 |
| AlogP: | 1.9 | Num_rotatable_bonds: | 4 |
| MolWt: | 228.68 | Num_heavy_atoms: | 15 |
| TPSA: | 64.35 | NumAromaticRings: | 1 |
