Glycoside
GD064906
Name:
NoneFormula:
C14H20O7N4Smiles:
NC(=O)[C@H]1CCn2nccc2CN1C(=O)[C@H]1O[C@H](O)[C@H](O)[C@@H](O)[C@H]1OAglycone:
NC(=O)C1CCn2nccc2CN1C=OSugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.64 |
| AlogP: | -3.73 | Num_rotatable_bonds: | 2 |
| MolWt: | 356.34 | Num_heavy_atoms: | 25 |
| TPSA: | 171.37 | NumAromaticRings: | 1 |
Unique Aglycone
AD31225
Formula: C9H12O2N4
Smiles:
NC(=O)C1CCn2nccc2CN1C=O| HBA: | 6 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.44 |
| AlogP: | -0.9 | Num_rotatable_bonds: | 2 |
| MolWt: | 208.22 | Num_heavy_atoms: | 15 |
| TPSA: | 81.22 | NumAromaticRings: | 1 |
