Glycoside
GD044391
Name:
NoneFormula:
C9H14O6N4Smiles:
Cn1[nH]cn/c1=N\C(=O)C(=O)[C@H](O)[C@@H](O)[C@H](O)COAglycone:
Cn1[nH]cnc1=NSugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.56 |
| AlogP: | -4.18 | Num_rotatable_bonds: | 5 |
| MolWt: | 274.23 | Num_heavy_atoms: | 19 |
| TPSA: | 161.03 | NumAromaticRings: | 1 |
Unique Aglycone
AD25005
Formula: C3H6N4
Smiles:
Cn1[nH]cnc1=N| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.33 |
| AlogP: | -0.77 | Num_rotatable_bonds: | 0 |
| MolWt: | 98.11 | Num_heavy_atoms: | 7 |
| TPSA: | 57.46 | NumAromaticRings: | 1 |
