Glycoside
GD021955
Name:
NoneFormula:
C22H29O7N5Smiles:
COc1cc(CCCNc2ncnc3c2ncn3C2O[C@H](CO)[C@H](O)[C@H]2O)cc(OC)c1OCAglycone:
COc1cc(CCCNc2ncnc3c2N=C[N]3)cc(OC)c1OCSugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.5 |
| AlogP: | 0.51 | Num_rotatable_bonds: | 10 |
| MolWt: | 475.5 | Num_heavy_atoms: | 34 |
| TPSA: | 153.24 | NumAromaticRings: | 3 |
Unique Aglycone
AD14941
Formula: C17H20O3N5
Smiles:
COc1cc(CCCNc2ncnc3c2N=C[N]3)cc(OC)c1OC| HBA: | 8 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.35 |
| AlogP: | 2.46 | Num_rotatable_bonds: | 8 |
| MolWt: | 342.38 | Num_heavy_atoms: | 25 |
| TPSA: | 91.96 | NumAromaticRings: | 2 |
