Glycoside
GD046879
Name:
NoneFormula:
C10H12O7N4Smiles:
O=c1[nH]c(=O)c2[nH]c(=O)n([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2[nH]1Aglycone:
O=c1[nH]c(=O)c2[nH]c(=O)[nH]c2[nH]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.5 |
| AlogP: | -3.68 | Num_rotatable_bonds: | 2 |
| MolWt: | 300.23 | Num_heavy_atoms: | 21 |
| TPSA: | 173.43 | NumAromaticRings: | 2 |
Unique Aglycone
AD25423
Formula: C5H4O3N4
Smiles:
O=c1[nH]c(=O)c2[nH]c(=O)[nH]c2[nH]1| HBA: | 7 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.0 |
| AlogP: | -1.77 | Num_rotatable_bonds: | 0 |
| MolWt: | 168.11 | Num_heavy_atoms: | 12 |
| TPSA: | 114.37 | NumAromaticRings: | 2 |
