Glycoside
GD091278
Name:
NoneFormula:
C19H25O8NSSmiles:
COc1ccc2cc(S(=O)(=O)NCCO[C@@H]3O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]3O)ccc2c1Aglycone:
COc1ccc2cc(S(=O)(=O)NCCO)ccc2c1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.47 |
| AlogP: | -0.03 | Num_rotatable_bonds: | 7 |
| MolWt: | 427.48 | Num_heavy_atoms: | 29 |
| TPSA: | 134.55 | NumAromaticRings: | 2 |
Unique Aglycone
AD39809
Formula: C13H15O4NS
Smiles:
COc1ccc2cc(S(=O)(=O)NCCO)ccc2c1| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.23 |
| AlogP: | 1.12 | Num_rotatable_bonds: | 5 |
| MolWt: | 281.33 | Num_heavy_atoms: | 19 |
| TPSA: | 75.63 | NumAromaticRings: | 2 |
