Glycoside
GD022546
Name:
NoneFormula:
C11H17O5N3Smiles:
CC(=O)c1nc([C@H](O)[C@H](O)[C@H](O)C(=O)N(C)C)c[nH]1Aglycone:
CC(=O)c1ncc[nH]1Sugarmoiety:
CN(C)C(=O)C(O)C(O)C(O)OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.55 |
| AlogP: | -1.54 | Num_rotatable_bonds: | 5 |
| MolWt: | 271.27 | Num_heavy_atoms: | 19 |
| TPSA: | 126.75 | NumAromaticRings: | 1 |
Unique Aglycone
AD09119
Formula: C5H6ON2
Smiles:
CC(=O)c1ncc[nH]1| HBA: | 3 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.2 |
| AlogP: | 0.61 | Num_rotatable_bonds: | 1 |
| MolWt: | 110.12 | Num_heavy_atoms: | 8 |
| TPSA: | 45.75 | NumAromaticRings: | 1 |
