Glycoside
GD016820
Name:
NoneFormula:
C22H28O6N6Smiles:
CCOC(=O)Cc1ccc(CCNc2nc(N)c3ncn([C@@H]4O[C@H](CO)[C@H](O)[C@H]4O)c3n2)cc1Aglycone:
CCOC(=O)Cc1ccc(CCNc2nc(N)c3c(n2)[N]C=N3)cc1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.45 |
| AlogP: | -0.22 | Num_rotatable_bonds: | 9 |
| MolWt: | 472.5 | Num_heavy_atoms: | 34 |
| TPSA: | 177.87 | NumAromaticRings: | 3 |
Unique Aglycone
AD12064
Formula: C17H19O2N6
Smiles:
CCOC(=O)Cc1ccc(CCNc2nc(N)c3c(n2)[N]C=N3)cc1| HBA: | 8 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.29 |
| AlogP: | 1.73 | Num_rotatable_bonds: | 7 |
| MolWt: | 339.38 | Num_heavy_atoms: | 25 |
| TPSA: | 116.59 | NumAromaticRings: | 2 |
