Glycoside
GD022419
Name:
NoneFormula:
C25H25O5N9Smiles:
CCNC(=O)c1cnn(-c2nc(Nc3ccc4ccccc4n3)c3ncn([C@@H]4O[C@H](CO)[C@H](O)[C@H]4O)c3n2)c1Aglycone:
CCNC(=O)c1cnn(-c2nc3c(c(Nc4ccc5ccccc5n4)n2)N=C[N]3)c1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 6 |
| HBD: | 5 | FractionCSP3: | 0.28 |
| AlogP: | 0.66 | Num_rotatable_bonds: | 7 |
| MolWt: | 531.53 | Num_heavy_atoms: | 39 |
| TPSA: | 185.36 | NumAromaticRings: | 5 |
Unique Aglycone
AD15200
Formula: C20H16ON9
Smiles:
CCNC(=O)c1cnn(-c2nc3c(c(Nc4ccc5ccccc5n4)n2)N=C[N]3)c1| HBA: | 10 | RingCount: | 5 |
| HBD: | 2 | FractionCSP3: | 0.1 |
| AlogP: | 2.61 | Num_rotatable_bonds: | 5 |
| MolWt: | 398.41 | Num_heavy_atoms: | 30 |
| TPSA: | 124.08 | NumAromaticRings: | 4 |
