Glycoside
GD070539
Name:
NoneFormula:
C16H24O7N2Smiles:
CC(C)(C)c1ccc(N[C@H]2[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)c([N+](=O)[O-])c1Aglycone:
CC(C)(C)c1ccc(N)c([N+](=O)[O-])c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.62 |
| AlogP: | 0.1 | Num_rotatable_bonds: | 4 |
| MolWt: | 356.38 | Num_heavy_atoms: | 25 |
| TPSA: | 145.32 | NumAromaticRings: | 1 |
Unique Aglycone
AD33437
Formula: C10H14O2N2
Smiles:
CC(C)(C)c1ccc(N)c([N+](=O)[O-])c1| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.4 |
| AlogP: | 2.47 | Num_rotatable_bonds: | 1 |
| MolWt: | 194.23 | Num_heavy_atoms: | 14 |
| TPSA: | 69.16 | NumAromaticRings: | 1 |
