Glycoside
GD039368
Name:
2-(butylsulfanyl)adenosineFormula:
C14H21O4N5SSmiles:
CCCCSc1nc(N)c2ncn([C@H]3O[C@H](CO)[C@H](O)[C@@H]3O)c2n1Aglycone:
CCCCSc1nc(N)c2c(n1)[N]C=N2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.64 |
| AlogP: | -0.09 | Num_rotatable_bonds: | 6 |
| MolWt: | 355.42 | Num_heavy_atoms: | 24 |
| TPSA: | 139.54 | NumAromaticRings: | 2 |
Unique Aglycone
AD03795
Formula: C9H12N5S
Smiles:
CCCCSc1nc(N)c2c(n1)[N]C=N2| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.44 |
| AlogP: | 1.86 | Num_rotatable_bonds: | 4 |
| MolWt: | 222.3 | Num_heavy_atoms: | 15 |
| TPSA: | 78.26 | NumAromaticRings: | 1 |
