Glycoside
GD044337
Name:
NoneFormula:
C11H15O6N4Smiles:
C[n+]1cn([C@@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)c2[nH]c(=O)[nH]c(=O)c21Aglycone:
C[N+]1=C[N]c2[nH]c(=O)[nH]c(=O)c21Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.55 |
| AlogP: | -3.55 | Num_rotatable_bonds: | 2 |
| MolWt: | 299.26 | Num_heavy_atoms: | 21 |
| TPSA: | 144.45 | NumAromaticRings: | 2 |
Unique Aglycone
AD24984
Formula: C6H6O2N4
Smiles:
C[N+]1=C[N]c2[nH]c(=O)[nH]c(=O)c21| HBA: | 6 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.17 |
| AlogP: | -1.39 | Num_rotatable_bonds: | 0 |
| MolWt: | 166.14 | Num_heavy_atoms: | 12 |
| TPSA: | 82.83 | NumAromaticRings: | 1 |
