Glycoside
GD000638
Name:
NoneFormula:
C21H22O7N2Smiles:
OC[C@@H]1O[C@H](c2nc(-c3ccc(OCc4ccccc4)cc3)no2)[C@H](O)[C@H](O)[C@H]1OAglycone:
c1ccc(COc2ccc(-c3ncon3)cc2)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.33 |
| AlogP: | 0.83 | Num_rotatable_bonds: | 6 |
| MolWt: | 414.41 | Num_heavy_atoms: | 30 |
| TPSA: | 138.3 | NumAromaticRings: | 3 |
Unique Aglycone
AD00693
Formula: C15H12O2N2
Smiles:
c1ccc(COc2ccc(-c3ncon3)cc2)cc1| HBA: | 4 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.07 |
| AlogP: | 3.32 | Num_rotatable_bonds: | 4 |
| MolWt: | 252.27 | Num_heavy_atoms: | 19 |
| TPSA: | 48.15 | NumAromaticRings: | 3 |
