Glycoside
GD015105
Name:
NoneFormula:
C11H15O5N3Smiles:
Cc1cc(-c2nc([C@H](O)[C@H](O)[C@H](O)CO)c[nH]2)no1Aglycone:
Cc1cc(-c2ncc[nH]2)no1Sugarmoiety:
OCC(O)C(O)C(O)OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.45 |
| AlogP: | -0.88 | Num_rotatable_bonds: | 5 |
| MolWt: | 269.26 | Num_heavy_atoms: | 19 |
| TPSA: | 135.63 | NumAromaticRings: | 2 |
Unique Aglycone
AD11019
Formula: C7H7ON3
Smiles:
Cc1cc(-c2ncc[nH]2)no1| HBA: | 4 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.14 |
| AlogP: | 1.37 | Num_rotatable_bonds: | 1 |
| MolWt: | 149.15 | Num_heavy_atoms: | 11 |
| TPSA: | 54.71 | NumAromaticRings: | 2 |
