Glycoside
GD024490
Name:
NoneFormula:
C25H30O12N4Smiles:
O=C(Cc1ccc([N+](=O)[O-])cc1)NCC(CNC(=O)Cc1ccc([N+](=O)[O-])cc1)O[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1OAglycone:
O=C(Cc1ccc([N+](=O)[O-])cc1)NCC(O)CNC(=O)Cc1ccc([N+](=O)[O-])cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 16 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.44 |
| AlogP: | -1.29 | Num_rotatable_bonds: | 13 |
| MolWt: | 578.53 | Num_heavy_atoms: | 41 |
| TPSA: | 243.86 | NumAromaticRings: | 2 |
Unique Aglycone
AD16335
Formula: C19H20O7N4
Smiles:
O=C(Cc1ccc([N+](=O)[O-])cc1)NCC(O)CNC(=O)Cc1ccc([N+](=O)[O-])cc1| HBA: | 11 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.26 |
| AlogP: | 0.88 | Num_rotatable_bonds: | 10 |
| MolWt: | 416.39 | Num_heavy_atoms: | 30 |
| TPSA: | 164.71 | NumAromaticRings: | 2 |
