Glycoside
GD085187
Name:
NoneFormula:
C16H22O5N6SSmiles:
C=CCSCC(=O)n1c(N)c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3OC)c2nc1=NAglycone:
C=CCSCC(=O)n1c(N)c2c(nc1=N)[N]C=N2Sugarmoiety:
COC1C(O)OC(CO)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | -0.88 | Num_rotatable_bonds: | 7 |
| MolWt: | 410.46 | Num_heavy_atoms: | 28 |
| TPSA: | 161.5 | NumAromaticRings: | 2 |
Unique Aglycone
AD38105
Formula: C10H11ON6S
Smiles:
C=CCSCC(=O)n1c(N)c2c(nc1=N)[N]C=N2| HBA: | 7 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.2 |
| AlogP: | 0.41 | Num_rotatable_bonds: | 4 |
| MolWt: | 263.31 | Num_heavy_atoms: | 18 |
| TPSA: | 111.22 | NumAromaticRings: | 1 |
