Glycoside
GD051428
Name:
NoneFormula:
C13H20O5N2SSmiles:
CCSc1ccnc(N[C@H]2[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)c1Aglycone:
CCSc1ccnc(N)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.62 |
| AlogP: | -0.59 | Num_rotatable_bonds: | 5 |
| MolWt: | 316.38 | Num_heavy_atoms: | 21 |
| TPSA: | 115.07 | NumAromaticRings: | 1 |
Unique Aglycone
AD26883
Formula: C7H10N2S
Smiles:
CCSc1ccnc(N)c1| HBA: | 2 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.29 |
| AlogP: | 1.78 | Num_rotatable_bonds: | 2 |
| MolWt: | 154.24 | Num_heavy_atoms: | 10 |
| TPSA: | 38.91 | NumAromaticRings: | 1 |
