Glycoside
GD045118
Name:
NoneFormula:
C13H19O5N3Smiles:
C#CCCCc1cn([C@H]2[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)nn1Aglycone:
C#CCCCC1=C[N]N=N1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.69 |
| AlogP: | -1.79 | Num_rotatable_bonds: | 5 |
| MolWt: | 297.31 | Num_heavy_atoms: | 21 |
| TPSA: | 120.86 | NumAromaticRings: | 1 |
Unique Aglycone
AD25195
Formula: C7H8N3
Smiles:
C#CCCCC1=C[N]N=N1| HBA: | 3 | RingCount: | 1 |
| HBD: | 0 | FractionCSP3: | 0.43 |
| AlogP: | 1.62 | Num_rotatable_bonds: | 3 |
| MolWt: | 134.16 | Num_heavy_atoms: | 10 |
| TPSA: | 38.82 | NumAromaticRings: | 0 |
