Glycoside
GD029801
Name:
NoneFormula:
C12H17O4N7Smiles:
CNC(=O)[C@@H]1O[C@H](n2cnc3c(NC)nc(N)nc32)[C@H](O)[C@H]1OAglycone:
CNc1nc(N)nc2c1N=C[N]2Sugarmoiety:
CNC(=O)C1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.5 |
| AlogP: | -2.18 | Num_rotatable_bonds: | 3 |
| MolWt: | 323.31 | Num_heavy_atoms: | 23 |
| TPSA: | 160.44 | NumAromaticRings: | 2 |
Unique Aglycone
AD06216
Formula: C6H7N6
Smiles:
CNc1nc(N)nc2c1N=C[N]2| HBA: | 6 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.17 |
| AlogP: | 0.01 | Num_rotatable_bonds: | 1 |
| MolWt: | 163.16 | Num_heavy_atoms: | 12 |
| TPSA: | 90.29 | NumAromaticRings: | 1 |
