Glycoside
GD087857
Name:
NoneFormula:
C13H14O6N3ISmiles:
O=C(Nc1cc(I)c2nccn2c1)C(=O)[C@H](O)[C@@H](O)[C@@H](O)COAglycone:
Nc1cc(I)c2nccn2c1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.31 |
| AlogP: | -1.48 | Num_rotatable_bonds: | 6 |
| MolWt: | 435.17 | Num_heavy_atoms: | 23 |
| TPSA: | 144.39 | NumAromaticRings: | 2 |
Unique Aglycone
AD38527
Formula: C7H6N3I
Smiles:
Nc1cc(I)c2nccn2c1| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 1.52 | Num_rotatable_bonds: | 0 |
| MolWt: | 259.05 | Num_heavy_atoms: | 11 |
| TPSA: | 43.32 | NumAromaticRings: | 2 |
