Glycoside
GD134865
Name:
2-amino-9-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-8-(4-methylpiperidin-1-yl)-6,9-dihydro-1H-purin-6-oneFormula:
C16H24O5N6Smiles:
CC1CCN(c2nc3c(O)nc(=N)[nH]c3n2C2OC(CO)C(O)C2O)CC1Aglycone:
CC1CCN(C2=Nc3c(O)nc(=N)[nH]c3[N]2)CC1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.69 |
| AlogP: | -1.21 | Num_rotatable_bonds: | 3 |
| MolWt: | 380.41 | Num_heavy_atoms: | 27 |
| TPSA: | 163.74 | NumAromaticRings: | 2 |
Unique Aglycone
AD54553
Formula: C11H15ON6
Smiles:
CC1CCN(C2=Nc3c(O)nc(=N)[nH]c3[N]2)CC1| HBA: | 7 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.55 |
| AlogP: | 0.56 | Num_rotatable_bonds: | 0 |
| MolWt: | 247.28 | Num_heavy_atoms: | 18 |
| TPSA: | 102.46 | NumAromaticRings: | 1 |
