Glycoside
GD139002
Name:
2-(hydroxymethyl)-6-{6-[(3-methylbut-2-en-1-yl)amino]-7H-purin-7-yl}oxane-3,4,5-triolFormula:
C16H23O5N5Smiles:
CC(C)=CCNc1ncnc2ncn(C3OC(CO)C(O)C(O)C3O)c12Aglycone:
CC(C)=CCNc1ncnc2c1[N]C=N2Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.56 |
| AlogP: | -0.82 | Num_rotatable_bonds: | 5 |
| MolWt: | 365.39 | Num_heavy_atoms: | 26 |
| TPSA: | 145.78 | NumAromaticRings: | 2 |
Unique Aglycone
AD56068
Formula: C10H12N5
Smiles:
CC(C)=CCNc1ncnc2c1[N]C=N2| HBA: | 5 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.3 |
| AlogP: | 1.76 | Num_rotatable_bonds: | 3 |
| MolWt: | 202.24 | Num_heavy_atoms: | 15 |
| TPSA: | 64.27 | NumAromaticRings: | 1 |
