Glycoside
GD061389
Name:
NoneFormula:
C14H21O6NSSmiles:
Cc1sccc1C(=O)NCCO[C@@H]1O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]1OAglycone:
Cc1sccc1C(=O)NCCOSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.64 |
| AlogP: | -0.37 | Num_rotatable_bonds: | 5 |
| MolWt: | 331.39 | Num_heavy_atoms: | 22 |
| TPSA: | 108.25 | NumAromaticRings: | 1 |
Unique Aglycone
AD30116
Formula: C8H11O2NS
Smiles:
Cc1sccc1C(=O)NCCO| HBA: | 3 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.38 |
| AlogP: | 0.78 | Num_rotatable_bonds: | 3 |
| MolWt: | 185.25 | Num_heavy_atoms: | 12 |
| TPSA: | 49.33 | NumAromaticRings: | 1 |
