Glycoside
GD045408
Name:
NoneFormula:
C12H16O4N2Smiles:
C[C@H](O)[C@H](O)[C@@H](O)[C@@H](O)c1nc2ccccc2[nH]1Aglycone:
c1ccc2[nH]cnc2c1Sugarmoiety:
CC(O)C(O)C(O)C(O)OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.42 |
| AlogP: | -0.3 | Num_rotatable_bonds: | 4 |
| MolWt: | 252.27 | Num_heavy_atoms: | 18 |
| TPSA: | 109.6 | NumAromaticRings: | 2 |
Unique Aglycone
AD02933
Formula: C7H6N2
Smiles:
c1ccc2[nH]cnc2c1| HBA: | 2 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 1.56 | Num_rotatable_bonds: | 0 |
| MolWt: | 118.14 | Num_heavy_atoms: | 9 |
| TPSA: | 28.68 | NumAromaticRings: | 2 |
