Glycoside
GD029065
Name:
NoneFormula:
C14H14O5N4Smiles:
C#C[C@@]1(O)[C@H](CO)OC(n2ccc(=O)c3c(N)ncnc32)[C@H]1OAglycone:
Nc1ncnc2c1C(=O)C=C[N]2Sugarmoiety:
C#CC1(O)C(CO)OC(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.36 |
| AlogP: | -2.01 | Num_rotatable_bonds: | 2 |
| MolWt: | 318.29 | Num_heavy_atoms: | 23 |
| TPSA: | 143.72 | NumAromaticRings: | 2 |
Unique Aglycone
AD04080
Formula: C7H5ON4
Smiles:
Nc1ncnc2c1C(=O)C=C[N]2| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 0.0 | Num_rotatable_bonds: | 0 |
| MolWt: | 161.14 | Num_heavy_atoms: | 12 |
| TPSA: | 82.97 | NumAromaticRings: | 1 |
