Glycoside
GD122346
Name:
N-{9-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-6-oxo-6,9-dihydro-1H-purin-2-yl}-2-phenoxyacetamideFormula:
C18H19O7N5Smiles:
OCC1OC(n2cnc3c(O)nc(N=C(O)COc4ccccc4)nc32)C(O)C1OAglycone:
OC(COc1ccccc1)=Nc1nc(O)c2c(n1)[N]C=N2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.33 |
| AlogP: | -0.19 | Num_rotatable_bonds: | 6 |
| MolWt: | 417.38 | Num_heavy_atoms: | 30 |
| TPSA: | 175.57 | NumAromaticRings: | 3 |
Unique Aglycone
AD49292
Formula: C13H10O3N5
Smiles:
OC(COc1ccccc1)=Nc1nc(O)c2c(n1)[N]C=N2| HBA: | 8 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.08 |
| AlogP: | 1.76 | Num_rotatable_bonds: | 4 |
| MolWt: | 284.25 | Num_heavy_atoms: | 21 |
| TPSA: | 114.29 | NumAromaticRings: | 2 |
