Glycoside
GD009895
Name:
NoneFormula:
C16H25O9N5Smiles:
CC(=O)N[C@H]1[C@H](O)[C@@H](O)[C@@H](CO)O[C@H]1OCCN(C)C(=O)Cn1ccnc1[N+](=O)[O-]Aglycone:
CN(CCO)C(=O)Cn1ccnc1[N+](=O)[O-]Sugarmoiety:
CC(=O)NC1C(O)OC(CO)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.69 |
| AlogP: | -2.79 | Num_rotatable_bonds: | 9 |
| MolWt: | 431.4 | Num_heavy_atoms: | 30 |
| TPSA: | 189.52 | NumAromaticRings: | 1 |
Unique Aglycone
AD03471
Formula: C8H12O4N4
Smiles:
CN(CCO)C(=O)Cn1ccnc1[N+](=O)[O-]| HBA: | 8 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.5 |
| AlogP: | -0.76 | Num_rotatable_bonds: | 5 |
| MolWt: | 228.21 | Num_heavy_atoms: | 16 |
| TPSA: | 101.5 | NumAromaticRings: | 1 |
