Glycoside
GD040012
Name:
1-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1H-1,2,4-triazole-3-carboxamideFormula:
C8H12O5N4Smiles:
NC(=O)c1ncn([C@H]2O[C@H](CO)[C@H](O)[C@@H]2O)n1Aglycone:
NC(=O)C1=N[N]C=N1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.62 |
| AlogP: | -3.01 | Num_rotatable_bonds: | 3 |
| MolWt: | 244.21 | Num_heavy_atoms: | 17 |
| TPSA: | 143.72 | NumAromaticRings: | 1 |
Unique Aglycone
AD00218
Formula: C3H3ON4
Smiles:
NC(=O)C1=N[N]C=N1| HBA: | 5 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | -1.57 | Num_rotatable_bonds: | 1 |
| MolWt: | 111.08 | Num_heavy_atoms: | 8 |
| TPSA: | 81.91 | NumAromaticRings: | 0 |
