Glycoside
GD089300
Name:
NoneFormula:
C14H19O7NFSBrSmiles:
C[C@@H]1O[C@@H](OCCNS(=O)(=O)c2c(F)cccc2Br)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
O=S(=O)(NCCO)c1c(F)cccc1BrSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.57 |
| AlogP: | -0.29 | Num_rotatable_bonds: | 6 |
| MolWt: | 444.28 | Num_heavy_atoms: | 25 |
| TPSA: | 125.32 | NumAromaticRings: | 1 |
Unique Aglycone
AD38950
Formula: C8H9O3NFSBr
Smiles:
O=S(=O)(NCCO)c1c(F)cccc1Br| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.25 |
| AlogP: | 0.86 | Num_rotatable_bonds: | 4 |
| MolWt: | 298.13 | Num_heavy_atoms: | 15 |
| TPSA: | 66.4 | NumAromaticRings: | 1 |
