Glycoside
GD028099
Name:
NoneFormula:
C12H16O4N4SSmiles:
CCSc1ncnc2c1cnn2C1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
CCSc1ncnc2c1C=N[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.58 |
| AlogP: | -0.45 | Num_rotatable_bonds: | 4 |
| MolWt: | 312.35 | Num_heavy_atoms: | 21 |
| TPSA: | 113.52 | NumAromaticRings: | 2 |
Unique Aglycone
AD18396
Formula: C7H7N4S
Smiles:
CCSc1ncnc2c1C=N[N]2| HBA: | 4 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.29 |
| AlogP: | 1.17 | Num_rotatable_bonds: | 2 |
| MolWt: | 179.23 | Num_heavy_atoms: | 12 |
| TPSA: | 52.24 | NumAromaticRings: | 1 |
