Glycoside
GD006976
Name:
NoneFormula:
C19H24O6N6Smiles:
COc1cc(CCNc2nc(N)nc3c2ncn3C2O[C@H](CO)[C@H](O)[C@H]2O)ccc1OAglycone:
COc1cc(CCNc2nc(N)nc3c2N=C[N]3)ccc1OSugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 7 | FractionCSP3: | 0.42 |
| AlogP: | -0.61 | Num_rotatable_bonds: | 7 |
| MolWt: | 432.44 | Num_heavy_atoms: | 31 |
| TPSA: | 181.03 | NumAromaticRings: | 3 |
Unique Aglycone
AD05712
Formula: C14H15O2N6
Smiles:
COc1cc(CCNc2nc(N)nc3c2N=C[N]3)ccc1O| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.21 |
| AlogP: | 1.34 | Num_rotatable_bonds: | 5 |
| MolWt: | 299.31 | Num_heavy_atoms: | 22 |
| TPSA: | 119.75 | NumAromaticRings: | 2 |
