Glycoside
GD015191
Name:
NoneFormula:
C21H27O5N7Smiles:
CCCCCc1ccc(-c2cn(-c3nc(C(N)=O)n([C@@H]4O[C@H](CO)[C@H](O)[C@H]4O)n3)nn2)cc1Aglycone:
CCCCCc1ccc(-c2cn(C3=N[N]C(C(N)=O)=N3)nn2)cc1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.48 |
| AlogP: | -0.03 | Num_rotatable_bonds: | 9 |
| MolWt: | 457.49 | Num_heavy_atoms: | 33 |
| TPSA: | 174.43 | NumAromaticRings: | 3 |
Unique Aglycone
AD11066
Formula: C16H18ON7
Smiles:
CCCCCc1ccc(-c2cn(C3=N[N]C(C(N)=O)=N3)nn2)cc1| HBA: | 8 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.31 |
| AlogP: | 1.3 | Num_rotatable_bonds: | 6 |
| MolWt: | 324.37 | Num_heavy_atoms: | 24 |
| TPSA: | 112.62 | NumAromaticRings: | 2 |
