Glycoside
GD084211
Name:
NoneFormula:
C18H25O8NSSmiles:
CC1(C)OC[C@H](C(=O)Nc2ccc(S[C@@H]3O[C@H](CO)[C@H](O)[C@@H](O)[C@@H]3O)cc2)O1Aglycone:
CC1(C)OCC(C(=O)Nc2ccc(S)cc2)O1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.61 |
| AlogP: | -0.33 | Num_rotatable_bonds: | 5 |
| MolWt: | 415.46 | Num_heavy_atoms: | 28 |
| TPSA: | 137.71 | NumAromaticRings: | 1 |
Unique Aglycone
AD37587
Formula: C12H15O3NS
Smiles:
CC1(C)OCC(C(=O)Nc2ccc(S)cc2)O1| HBA: | 4 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.42 |
| AlogP: | 2.07 | Num_rotatable_bonds: | 2 |
| MolWt: | 253.32 | Num_heavy_atoms: | 17 |
| TPSA: | 47.56 | NumAromaticRings: | 1 |
