Glycoside
GD088884
Name:
NoneFormula:
C20H32O7N3Smiles:
COc1ccc(N2CC[NH+](CCCNC(=O)C(=O)[C@H](O)[C@@H](O)[C@H](O)CO)CC2)cc1Aglycone:
COc1ccc(N2CC[NH+](CCCN)CC2)cc1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.6 |
| AlogP: | -3.45 | Num_rotatable_bonds: | 11 |
| MolWt: | 426.49 | Num_heavy_atoms: | 30 |
| TPSA: | 144.0 | NumAromaticRings: | 1 |
Unique Aglycone
AD38874
Formula: C14H24ON3
Smiles:
COc1ccc(N2CC[NH+](CCCN)CC2)cc1| HBA: | 4 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.57 |
| AlogP: | -0.25 | Num_rotatable_bonds: | 5 |
| MolWt: | 250.37 | Num_heavy_atoms: | 18 |
| TPSA: | 42.93 | NumAromaticRings: | 1 |
