Glycoside
GD091553
Name:
NoneFormula:
C14H15O6N2ISmiles:
Cc1cc(-c2noc(C(=O)[C@H](O)[C@@H](O)[C@H](O)CO)n2)ccc1IAglycone:
Cc1cc(-c2ncon2)ccc1ISugarmoiety:
O=C(O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.36 |
| AlogP: | -0.09 | Num_rotatable_bonds: | 6 |
| MolWt: | 434.19 | Num_heavy_atoms: | 23 |
| TPSA: | 136.91 | NumAromaticRings: | 2 |
Unique Aglycone
AD39957
Formula: C9H7ON2I
Smiles:
Cc1cc(-c2ncon2)ccc1I| HBA: | 3 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.11 |
| AlogP: | 2.65 | Num_rotatable_bonds: | 1 |
| MolWt: | 286.07 | Num_heavy_atoms: | 13 |
| TPSA: | 38.92 | NumAromaticRings: | 2 |
