Glycoside
GD022635
Name:
NoneFormula:
C16H23O4N5SSmiles:
C=CCCCCSc1nc(N)c2ncn(C3O[C@H](CO)[C@H](O)[C@H]3O)c2n1Aglycone:
C=CCCCCSc1nc(N)c2c(n1)[N]C=N2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.56 |
| AlogP: | 0.47 | Num_rotatable_bonds: | 8 |
| MolWt: | 381.46 | Num_heavy_atoms: | 26 |
| TPSA: | 139.54 | NumAromaticRings: | 2 |
Unique Aglycone
AD00643
Formula: C11H14N5S
Smiles:
C=CCCCCSc1nc(N)c2c(n1)[N]C=N2| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.36 |
| AlogP: | 2.42 | Num_rotatable_bonds: | 6 |
| MolWt: | 248.34 | Num_heavy_atoms: | 17 |
| TPSA: | 78.26 | NumAromaticRings: | 1 |
