Glycoside
GD042595
Name:
NoneFormula:
C13H15O4NSmiles:
O[C@H]1[C@@H](O)[C@H](O)CO[C@@H]1n1ccc2ccccc21Aglycone:
c1ccc2[nH]ccc2c1Sugarmoiety:
OC1COC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 5 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.38 |
| AlogP: | 0.25 | Num_rotatable_bonds: | 1 |
| MolWt: | 249.27 | Num_heavy_atoms: | 18 |
| TPSA: | 74.85 | NumAromaticRings: | 2 |
Unique Aglycone
AD05165
Formula: C8H7N
Smiles:
c1ccc2[nH]ccc2c1| HBA: | 1 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 2.17 | Num_rotatable_bonds: | 0 |
| MolWt: | 117.15 | Num_heavy_atoms: | 9 |
| TPSA: | 15.79 | NumAromaticRings: | 2 |
