Glycoside
GD006708
Name:
NoneFormula:
C12H16O4N6Smiles:
CNC(=O)[C@@H]1O[C@H](n2cnc3c(NC)ncnc32)[C@H](O)[C@H]1OAglycone:
CNc1ncnc2c1N=C[N]2Sugarmoiety:
CNC(=O)C1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.5 |
| AlogP: | -1.77 | Num_rotatable_bonds: | 3 |
| MolWt: | 308.3 | Num_heavy_atoms: | 22 |
| TPSA: | 134.42 | NumAromaticRings: | 2 |
Unique Aglycone
AD02186
Formula: C6H6N5
Smiles:
CNc1ncnc2c1N=C[N]2| HBA: | 5 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.17 |
| AlogP: | 0.43 | Num_rotatable_bonds: | 1 |
| MolWt: | 148.15 | Num_heavy_atoms: | 11 |
| TPSA: | 64.27 | NumAromaticRings: | 1 |
