Glycoside
GD008585
Name:
NoneFormula:
C14H17O9N3Smiles:
O=C(NC(=O)c1ccc([N+](=O)[O-])cc1)N[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1OAglycone:
NC(=O)NC(=O)c1ccc([N+](=O)[O-])cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.43 |
| AlogP: | -2.17 | Num_rotatable_bonds: | 4 |
| MolWt: | 371.3 | Num_heavy_atoms: | 26 |
| TPSA: | 191.49 | NumAromaticRings: | 1 |
Unique Aglycone
AD06835
Formula: C8H7O4N3
Smiles:
NC(=O)NC(=O)c1ccc([N+](=O)[O-])cc1| HBA: | 7 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | 0.4 | Num_rotatable_bonds: | 2 |
| MolWt: | 209.16 | Num_heavy_atoms: | 15 |
| TPSA: | 115.33 | NumAromaticRings: | 1 |
