Glycoside
GD018216
Name:
NoneFormula:
C12H17O5N3Smiles:
CCc1conc1-c1nc([C@H](O)[C@H](O)[C@H](O)CO)c[nH]1Aglycone:
CCc1conc1-c1ncc[nH]1Sugarmoiety:
OCC(O)C(O)C(O)OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | -0.63 | Num_rotatable_bonds: | 6 |
| MolWt: | 283.28 | Num_heavy_atoms: | 20 |
| TPSA: | 135.63 | NumAromaticRings: | 2 |
Unique Aglycone
AD12889
Formula: C8H9ON3
Smiles:
CCc1conc1-c1ncc[nH]1| HBA: | 4 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.25 |
| AlogP: | 1.63 | Num_rotatable_bonds: | 2 |
| MolWt: | 163.18 | Num_heavy_atoms: | 12 |
| TPSA: | 54.71 | NumAromaticRings: | 2 |
