Glycoside
GD005688
Name:
NoneFormula:
C19H20O5N8Smiles:
OCc1cnn(-c2nc(Nc3ccncc3)c3ncn([C@@H]4O[C@H](CO)[C@H](O)[C@H]4O)c3n2)c1Aglycone:
OCc1cnn(-c2nc3c(c(Nc4ccncc4)n2)N=C[N]3)c1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.32 |
| AlogP: | -0.75 | Num_rotatable_bonds: | 6 |
| MolWt: | 440.42 | Num_heavy_atoms: | 32 |
| TPSA: | 176.49 | NumAromaticRings: | 4 |
Unique Aglycone
AD04793
Formula: C14H11ON8
Smiles:
OCc1cnn(-c2nc3c(c(Nc4ccncc4)n2)N=C[N]3)c1| HBA: | 9 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.07 |
| AlogP: | 1.2 | Num_rotatable_bonds: | 4 |
| MolWt: | 307.3 | Num_heavy_atoms: | 23 |
| TPSA: | 115.21 | NumAromaticRings: | 3 |
