Glycoside
GD033477
Name:
9-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-8-(4-methylpiperidin-1-yl)-6,9-dihydro-1H-purin-6-oneFormula:
C16H23O5N5Smiles:
CC1CCN(c2nc3c(O)ncnc3n2C2OC(CO)C(O)C2O)CC1Aglycone:
CC1CCN(C2=Nc3c(O)ncnc3[N]2)CC1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.69 |
| AlogP: | -0.62 | Num_rotatable_bonds: | 3 |
| MolWt: | 365.39 | Num_heavy_atoms: | 26 |
| TPSA: | 136.99 | NumAromaticRings: | 2 |
Unique Aglycone
AD21367
Formula: C11H14ON5
Smiles:
CC1CCN(C2=Nc3c(O)ncnc3[N]2)CC1| HBA: | 6 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.55 |
| AlogP: | 1.15 | Num_rotatable_bonds: | 0 |
| MolWt: | 232.27 | Num_heavy_atoms: | 17 |
| TPSA: | 75.71 | NumAromaticRings: | 1 |
