Glycoside
GD009817
Name:
NoneFormula:
C12H13O5N5Smiles:
C#C[C@@]1(O)[C@H](CO)O[C@H](n2cnc3c(O)nc(N)nc32)[C@H]1OAglycone:
Nc1nc(O)c2c(n1)[N]C=N2Sugarmoiety:
C#CC1(O)C(CO)OC(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.42 |
| AlogP: | -2.27 | Num_rotatable_bonds: | 2 |
| MolWt: | 307.27 | Num_heavy_atoms: | 22 |
| TPSA: | 159.77 | NumAromaticRings: | 2 |
Unique Aglycone
AD00080
Formula: C5H4ON5
Smiles:
Nc1nc(O)c2c(n1)[N]C=N2| HBA: | 6 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | -0.33 | Num_rotatable_bonds: | 0 |
| MolWt: | 150.12 | Num_heavy_atoms: | 11 |
| TPSA: | 98.49 | NumAromaticRings: | 1 |
