Glycoside
GD102674
Name:
NoneFormula:
C23H30O5N6Smiles:
CCC(CC)(C(=O)n1c(N)c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3OC)c2nc1=N)c1ccccc1Aglycone:
CCC(CC)(C(=O)n1c(N)c2c(nc1=N)[N]C=N2)c1ccccc1Sugarmoiety:
COC1C(O)OC(CO)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.48 |
| AlogP: | 0.96 | Num_rotatable_bonds: | 7 |
| MolWt: | 470.53 | Num_heavy_atoms: | 34 |
| TPSA: | 161.5 | NumAromaticRings: | 3 |
Unique Aglycone
AD43468
Formula: C17H19ON6
Smiles:
CCC(CC)(C(=O)n1c(N)c2c(nc1=N)[N]C=N2)c1ccccc1| HBA: | 7 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.29 |
| AlogP: | 2.25 | Num_rotatable_bonds: | 4 |
| MolWt: | 323.38 | Num_heavy_atoms: | 24 |
| TPSA: | 111.22 | NumAromaticRings: | 2 |
