Glycoside
GD045524
Name:
NoneFormula:
C12H16O4N2Smiles:
Cc1ccc2nc([C@H](O)[C@@H](O)[C@H](O)CO)[nH]c2c1Aglycone:
Cc1ccc2nc[nH]c2c1Sugarmoiety:
OCC(O)C(O)C(O)OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.42 |
| AlogP: | -0.38 | Num_rotatable_bonds: | 4 |
| MolWt: | 252.27 | Num_heavy_atoms: | 18 |
| TPSA: | 109.6 | NumAromaticRings: | 2 |
Unique Aglycone
AD25264
Formula: C8H8N2
Smiles:
Cc1ccc2nc[nH]c2c1| HBA: | 2 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.12 |
| AlogP: | 1.87 | Num_rotatable_bonds: | 0 |
| MolWt: | 132.17 | Num_heavy_atoms: | 10 |
| TPSA: | 28.68 | NumAromaticRings: | 2 |
