Glycoside
GD080499
Name:
NoneFormula:
C15H20O9NFSSmiles:
C[C@@H]1O[C@@H](OCCNS(=O)(=O)c2ccc(F)c(C(=O)O)c2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
O=C(O)c1cc(S(=O)(=O)NCCO)ccc1FSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.53 |
| AlogP: | -1.35 | Num_rotatable_bonds: | 7 |
| MolWt: | 409.39 | Num_heavy_atoms: | 27 |
| TPSA: | 162.62 | NumAromaticRings: | 1 |
Unique Aglycone
AD36441
Formula: C9H10O5NFS
Smiles:
O=C(O)c1cc(S(=O)(=O)NCCO)ccc1F| HBA: | 6 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.22 |
| AlogP: | -0.21 | Num_rotatable_bonds: | 5 |
| MolWt: | 263.25 | Num_heavy_atoms: | 17 |
| TPSA: | 103.7 | NumAromaticRings: | 1 |
