Glycoside
GD093878
Name:
NoneFormula:
C21H34O8N3Smiles:
COc1ccc(NC(=O)C(=O)[C@H](O)[C@@H](O)[C@H](O)CO)cc1OCCC[NH+]1CCN(C)CC1Aglycone:
COc1ccc(N)cc1OCCC[NH+]1CCN(C)CC1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.62 |
| AlogP: | -3.12 | Num_rotatable_bonds: | 12 |
| MolWt: | 456.52 | Num_heavy_atoms: | 32 |
| TPSA: | 153.23 | NumAromaticRings: | 1 |
Unique Aglycone
AD40471
Formula: C15H26O2N3
Smiles:
COc1ccc(N)cc1OCCC[NH+]1CCN(C)CC1| HBA: | 5 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.6 |
| AlogP: | -0.12 | Num_rotatable_bonds: | 6 |
| MolWt: | 280.39 | Num_heavy_atoms: | 20 |
| TPSA: | 52.16 | NumAromaticRings: | 1 |
