Glycoside
GD027322
Name:
NoneFormula:
C13H19O5NSmiles:
N[C@H](c1ccccc1)[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1OAglycone:
NCc1ccccc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.54 |
| AlogP: | -1.47 | Num_rotatable_bonds: | 3 |
| MolWt: | 269.3 | Num_heavy_atoms: | 19 |
| TPSA: | 116.17 | NumAromaticRings: | 1 |
Unique Aglycone
AD02149
Formula: C7H9N
Smiles:
NCc1ccccc1| HBA: | 1 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.14 |
| AlogP: | 1.15 | Num_rotatable_bonds: | 1 |
| MolWt: | 107.16 | Num_heavy_atoms: | 8 |
| TPSA: | 26.02 | NumAromaticRings: | 1 |
