Glycoside
GD000405
Name:
NoneFormula:
C12H16O5N4Smiles:
NCc1cn([C@@H]2O[C@H](CO)[C@H](O)[C@H]2O)c2nc[nH]c(=O)c12Aglycone:
NCC1=C[N]c2nc[nH]c(=O)c21Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.5 |
| AlogP: | -2.21 | Num_rotatable_bonds: | 3 |
| MolWt: | 296.28 | Num_heavy_atoms: | 21 |
| TPSA: | 146.62 | NumAromaticRings: | 2 |
Unique Aglycone
AD00455
Formula: C7H7ON4
Smiles:
NCC1=C[N]c2nc[nH]c(=O)c21| HBA: | 5 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.14 |
| AlogP: | -0.68 | Num_rotatable_bonds: | 1 |
| MolWt: | 163.16 | Num_heavy_atoms: | 12 |
| TPSA: | 85.87 | NumAromaticRings: | 1 |
