Glycoside
GD124790
Name:
5'-MethylthioinosineFormula:
C11H14O4N4SSmiles:
CSCC1OC(n2cnc3c(O)ncnc32)C(O)C1OAglycone:
Oc1ncnc2c1N=C[N]2Sugarmoiety:
CSCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.55 |
| AlogP: | -0.49 | Num_rotatable_bonds: | 3 |
| MolWt: | 298.32 | Num_heavy_atoms: | 20 |
| TPSA: | 113.52 | NumAromaticRings: | 2 |
Unique Aglycone
AD00956
Formula: C5H3ON4
Smiles:
Oc1ncnc2c1N=C[N]2| HBA: | 5 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 0.09 | Num_rotatable_bonds: | 0 |
| MolWt: | 135.11 | Num_heavy_atoms: | 10 |
| TPSA: | 72.47 | NumAromaticRings: | 1 |
