Glycoside
GD153646
Name:
2-{6-[(5-hydroxy-4-methylpent-3-en-2-yl)amino]-9H-purin-9-yl}-5-(hydroxymethyl)oxolane-3,4-diolFormula:
C16H23O5N5Smiles:
CC(=CC(C)Nc1ncnc2c1ncn2C1OC(CO)C(O)C1O)COAglycone:
CC(=CC(C)Nc1ncnc2c1N=C[N]2)COSugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.56 |
| AlogP: | -0.82 | Num_rotatable_bonds: | 6 |
| MolWt: | 365.39 | Num_heavy_atoms: | 26 |
| TPSA: | 145.78 | NumAromaticRings: | 2 |
Unique Aglycone
AD61080
Formula: C11H14ON5
Smiles:
CC(=CC(C)Nc1ncnc2c1N=C[N]2)CO| HBA: | 6 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.36 |
| AlogP: | 1.12 | Num_rotatable_bonds: | 4 |
| MolWt: | 232.27 | Num_heavy_atoms: | 17 |
| TPSA: | 84.5 | NumAromaticRings: | 1 |
