Glycoside
GD009821
Name:
NoneFormula:
C14H15O5N5Smiles:
C#C[C@@]1(O)[C@H](O)[C@H](CO)O[C@H]1n1cc(C(N)=O)c2c(N)ncnc21Aglycone:
NC(=O)C1=C[N]c2ncnc(N)c21Sugarmoiety:
C#CC1(O)C(O)OC(CO)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 7 | FractionCSP3: | 0.36 |
| AlogP: | -2.27 | Num_rotatable_bonds: | 3 |
| MolWt: | 333.3 | Num_heavy_atoms: | 24 |
| TPSA: | 169.74 | NumAromaticRings: | 2 |
Unique Aglycone
AD01599
Formula: C7H6ON5
Smiles:
NC(=O)C1=C[N]c2ncnc(N)c21| HBA: | 6 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.0 |
| AlogP: | -0.87 | Num_rotatable_bonds: | 1 |
| MolWt: | 176.16 | Num_heavy_atoms: | 13 |
| TPSA: | 108.99 | NumAromaticRings: | 1 |
