Glycoside
GD135001
Name:
1-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-4-oxo-1,4-dihydropyridine-3-carboxamideFormula:
C11H14O6N2Smiles:
N=C(O)c1cn(C2OC(CO)C(O)C2O)ccc1=OAglycone:
N=C(O)c1c[nH]ccc1=OSugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.45 |
| AlogP: | -1.66 | Num_rotatable_bonds: | 3 |
| MolWt: | 270.24 | Num_heavy_atoms: | 19 |
| TPSA: | 136.0 | NumAromaticRings: | 1 |
Unique Aglycone
AD54608
Formula: C6H6O2N2
Smiles:
N=C(O)c1c[nH]ccc1=O| HBA: | 4 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | 0.26 | Num_rotatable_bonds: | 1 |
| MolWt: | 138.13 | Num_heavy_atoms: | 10 |
| TPSA: | 76.94 | NumAromaticRings: | 1 |
