Glycoside
GD025040
Name:
NoneFormula:
C20H25O7N7Smiles:
CCOC(=O)c1cnn(-c2nc(N[C@@H]3CCCO3)c3ncn([C@@H]4O[C@H](CO)[C@H](O)[C@H]4O)c3n2)c1Aglycone:
CCOC(=O)c1cnn(-c2nc3c(c(NC4CCCO4)n2)N=C[N]3)c1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.55 |
| AlogP: | -0.65 | Num_rotatable_bonds: | 7 |
| MolWt: | 475.46 | Num_heavy_atoms: | 34 |
| TPSA: | 178.9 | NumAromaticRings: | 3 |
Unique Aglycone
AD16648
Formula: C15H16O3N7
Smiles:
CCOC(=O)c1cnn(-c2nc3c(c(NC4CCCO4)n2)N=C[N]3)c1| HBA: | 10 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.4 |
| AlogP: | 1.3 | Num_rotatable_bonds: | 5 |
| MolWt: | 342.34 | Num_heavy_atoms: | 25 |
| TPSA: | 117.62 | NumAromaticRings: | 2 |
