Glycoside
GD044232
Name:
4-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1-methyl-1H,4H,5H-[1,2,3]triazolo[4,5-b]pyridin-5-oneFormula:
C11H14O5N4Smiles:
Cn1nnc2c1ccc(=O)n2[C@@H]1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
Cn1nnc2[nH]c(=O)ccc21Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.55 |
| AlogP: | -2.26 | Num_rotatable_bonds: | 2 |
| MolWt: | 282.26 | Num_heavy_atoms: | 20 |
| TPSA: | 122.63 | NumAromaticRings: | 2 |
Unique Aglycone
AD24931
Formula: C6H6ON4
Smiles:
Cn1nnc2[nH]c(=O)ccc21| HBA: | 5 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.17 |
| AlogP: | -0.34 | Num_rotatable_bonds: | 0 |
| MolWt: | 150.14 | Num_heavy_atoms: | 11 |
| TPSA: | 63.57 | NumAromaticRings: | 2 |
