Glycoside
GD081202
Name:
NoneFormula:
C19H25O7N2ClSmiles:
O=C(N[C@H]1[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]1O)[C@H](c1ccccc1Cl)N1CCOCC1Aglycone:
NC(=O)C(c1ccccc1Cl)N1CCOCC1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.61 |
| AlogP: | -1.37 | Num_rotatable_bonds: | 5 |
| MolWt: | 416.86 | Num_heavy_atoms: | 28 |
| TPSA: | 131.72 | NumAromaticRings: | 1 |
Unique Aglycone
AD36617
Formula: C13H15O2N2Cl
Smiles:
NC(=O)C(c1ccccc1Cl)N1CCOCC1| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.42 |
| AlogP: | 1.2 | Num_rotatable_bonds: | 3 |
| MolWt: | 254.72 | Num_heavy_atoms: | 17 |
| TPSA: | 55.56 | NumAromaticRings: | 1 |
