Glycoside
GD017157
Name:
NoneFormula:
C26H26O13F4Smiles:
O=C(OC[C@@H]1O[C@H](O[C@@H]2O[C@H](COC(=O)c3c(F)cccc3F)[C@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O)c1c(F)cccc1FAglycone:
COC(=O)c1c(F)cccc1F.COC(=O)c1c(F)cccc1FSugarmoiety:
OC1OC(OC2OC(O)C(O)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.46 |
| AlogP: | -1.11 | Num_rotatable_bonds: | 8 |
| MolWt: | 622.47 | Num_heavy_atoms: | 43 |
| TPSA: | 201.67 | NumAromaticRings: | 2 |
Unique Aglycone
AD12278
Formula: C8H6O2F2
Smiles:
COC(=O)c1c(F)cccc1F| HBA: | 2 | RingCount: | 1 |
| HBD: | 0 | FractionCSP3: | 0.12 |
| AlogP: | 1.75 | Num_rotatable_bonds: | 1 |
| MolWt: | 172.13 | Num_heavy_atoms: | 12 |
| TPSA: | 26.3 | NumAromaticRings: | 1 |
