Glycoside
GD147091
Name:
N-{1-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-oxo-1,2-dihydropyrimidin-4-yl}-3,4,5-trimethoxybenzamideFormula:
C19H23O9N3Smiles:
COc1cc(C(=O)N=c2ccn(C3OC(CO)C(O)C3O)c(O)n2)cc(OC)c1OCAglycone:
COc1cc(C(=O)N=C2C=C[N]C(O)=N2)cc(OC)c1OCSugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.42 |
| AlogP: | -1.03 | Num_rotatable_bonds: | 6 |
| MolWt: | 437.41 | Num_heavy_atoms: | 31 |
| TPSA: | 165.09 | NumAromaticRings: | 2 |
Unique Aglycone
AD58918
Formula: C14H14O5N3
Smiles:
COc1cc(C(=O)N=C2C=C[N]C(O)=N2)cc(OC)c1OC| HBA: | 8 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.21 |
| AlogP: | 1.3 | Num_rotatable_bonds: | 4 |
| MolWt: | 304.28 | Num_heavy_atoms: | 22 |
| TPSA: | 103.81 | NumAromaticRings: | 1 |
