Glycoside
GD060343
Name:
NoneFormula:
C13H20O6N2SSmiles:
COc1cc(SC)c(N[C@H]2[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)cn1Aglycone:
COc1cc(SC)c(N)cn1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.62 |
| AlogP: | -0.98 | Num_rotatable_bonds: | 5 |
| MolWt: | 332.38 | Num_heavy_atoms: | 22 |
| TPSA: | 124.3 | NumAromaticRings: | 1 |
Unique Aglycone
AD29825
Formula: C7H10ON2S
Smiles:
COc1cc(SC)c(N)cn1| HBA: | 3 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.29 |
| AlogP: | 1.39 | Num_rotatable_bonds: | 2 |
| MolWt: | 170.24 | Num_heavy_atoms: | 11 |
| TPSA: | 48.14 | NumAromaticRings: | 1 |
