Glycoside
GD088565
Name:
NoneFormula:
C18H25O9NSSmiles:
COC(=O)/C=C/c1cccc(S(=O)(=O)NCCO[C@@H]2O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]2O)c1Aglycone:
COC(=O)C=Cc1cccc(S(=O)(=O)NCCO)c1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.5 |
| AlogP: | -1.0 | Num_rotatable_bonds: | 8 |
| MolWt: | 431.46 | Num_heavy_atoms: | 29 |
| TPSA: | 151.62 | NumAromaticRings: | 1 |
Unique Aglycone
AD38750
Formula: C12H15O5NS
Smiles:
COC(=O)C=Cc1cccc(S(=O)(=O)NCCO)c1| HBA: | 6 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.25 |
| AlogP: | 0.14 | Num_rotatable_bonds: | 6 |
| MolWt: | 285.32 | Num_heavy_atoms: | 19 |
| TPSA: | 92.7 | NumAromaticRings: | 1 |
