Glycoside
GD006560
Name:
NoneFormula:
C23H22O5N8Smiles:
OCc1cnn(-c2nc(Nc3ccc4ccccc4n3)c3ncn([C@@H]4O[C@H](CO)[C@H](O)[C@H]4O)c3n2)c1Aglycone:
OCc1cnn(-c2nc3c(c(Nc4ccc5ccccc5n4)n2)N=C[N]3)c1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 6 |
| HBD: | 5 | FractionCSP3: | 0.26 |
| AlogP: | 0.41 | Num_rotatable_bonds: | 6 |
| MolWt: | 490.48 | Num_heavy_atoms: | 36 |
| TPSA: | 176.49 | NumAromaticRings: | 5 |
Unique Aglycone
AD05419
Formula: C18H13ON8
Smiles:
OCc1cnn(-c2nc3c(c(Nc4ccc5ccccc5n4)n2)N=C[N]3)c1| HBA: | 9 | RingCount: | 5 |
| HBD: | 2 | FractionCSP3: | 0.06 |
| AlogP: | 2.36 | Num_rotatable_bonds: | 4 |
| MolWt: | 357.36 | Num_heavy_atoms: | 27 |
| TPSA: | 115.21 | NumAromaticRings: | 4 |
