Glycoside
GD150207
Name:
9-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-6-(dimethylamino)-3,9-dihydro-2H-purin-2-oneFormula:
C12H17O5N5Smiles:
CN(C)c1nc(O)nc2c1ncn2C1OC(CO)C(O)C1OAglycone:
CN(C)c1nc(O)nc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.58 |
| AlogP: | -1.79 | Num_rotatable_bonds: | 3 |
| MolWt: | 311.3 | Num_heavy_atoms: | 22 |
| TPSA: | 136.99 | NumAromaticRings: | 2 |
Unique Aglycone
AD60017
Formula: C7H8ON5
Smiles:
CN(C)c1nc(O)nc2c1N=C[N]2| HBA: | 6 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.29 |
| AlogP: | 0.16 | Num_rotatable_bonds: | 1 |
| MolWt: | 178.18 | Num_heavy_atoms: | 13 |
| TPSA: | 75.71 | NumAromaticRings: | 1 |
