Glycoside
GD013980
Name:
NoneFormula:
C13H16O3N6SSmiles:
CNc1nc(C#N)nc2c1ncn2[C@@H]1O[C@H](CSC)[C@H](O)[C@H]1OAglycone:
CNc1nc(C#N)nc2c1N=C[N]2Sugarmoiety:
CSCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.54 |
| AlogP: | -0.28 | Num_rotatable_bonds: | 4 |
| MolWt: | 336.38 | Num_heavy_atoms: | 23 |
| TPSA: | 129.11 | NumAromaticRings: | 2 |
Unique Aglycone
AD08523
Formula: C7H5N6
Smiles:
CNc1nc(C#N)nc2c1N=C[N]2| HBA: | 6 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.14 |
| AlogP: | 0.3 | Num_rotatable_bonds: | 1 |
| MolWt: | 173.16 | Num_heavy_atoms: | 13 |
| TPSA: | 88.06 | NumAromaticRings: | 1 |
