Glycoside
GD075927
Name:
NoneFormula:
C16H21O8N3Smiles:
CC(=O)N1CCc2cc(N[C@H]3[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]3O)cc([N+](=O)[O-])c21Aglycone:
CC(=O)N1CCc2cc(N)cc([N+](=O)[O-])c21Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.56 |
| AlogP: | -1.28 | Num_rotatable_bonds: | 4 |
| MolWt: | 383.36 | Num_heavy_atoms: | 27 |
| TPSA: | 165.63 | NumAromaticRings: | 1 |
Unique Aglycone
AD35141
Formula: C10H11O3N3
Smiles:
CC(=O)N1CCc2cc(N)cc([N+](=O)[O-])c21| HBA: | 6 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.3 |
| AlogP: | 1.09 | Num_rotatable_bonds: | 1 |
| MolWt: | 221.22 | Num_heavy_atoms: | 16 |
| TPSA: | 89.47 | NumAromaticRings: | 1 |
