Glycoside
GD024840
Name:
NoneFormula:
C16H18O4N6SSmiles:
C=CCSc1ncnc2c1c1c(N)ncnc1n2C1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
C=CCSc1ncnc2c1-c1c(N)ncnc1[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.38 |
| AlogP: | -0.15 | Num_rotatable_bonds: | 5 |
| MolWt: | 390.43 | Num_heavy_atoms: | 27 |
| TPSA: | 152.43 | NumAromaticRings: | 3 |
Unique Aglycone
AD16537
Formula: C11H9N6S
Smiles:
C=CCSc1ncnc2c1-c1c(N)ncnc1[N]2| HBA: | 6 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.09 |
| AlogP: | 1.67 | Num_rotatable_bonds: | 3 |
| MolWt: | 257.3 | Num_heavy_atoms: | 18 |
| TPSA: | 91.68 | NumAromaticRings: | 2 |
