Glycoside
GD029468
Name:
NoneFormula:
C21H20O6NF3SSmiles:
OC[C@@H]1O[C@H](c2ccc(C(F)(F)F)c(Cc3ncc(-c4ccco4)s3)c2)[C@H](O)[C@H](O)[C@H]1OAglycone:
FC(F)(F)c1ccccc1Cc1ncc(-c2ccco2)s1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.38 |
| AlogP: | 2.53 | Num_rotatable_bonds: | 5 |
| MolWt: | 471.45 | Num_heavy_atoms: | 32 |
| TPSA: | 116.18 | NumAromaticRings: | 3 |
Unique Aglycone
AD19165
Formula: C15H10ONF3S
Smiles:
FC(F)(F)c1ccccc1Cc1ncc(-c2ccco2)s1| HBA: | 2 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.13 |
| AlogP: | 5.01 | Num_rotatable_bonds: | 3 |
| MolWt: | 309.31 | Num_heavy_atoms: | 21 |
| TPSA: | 26.03 | NumAromaticRings: | 3 |
