Glycoside
...
GD109051

Name:
[3,4,5-tris(acetyloxy)-6-{4-[2-(4-fluorophenoxy)acetyl]-3-hydroxyphenoxy}oxan-2-yl]methyl acetate

Formula:
C28H29O13F

Smiles:
CC(=O)OC[C@@H]1O[C@@H](Oc2ccc(C(=O)COc3ccc(F)cc3)c(O)c2)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O

Aglycone:
COC(C)=O.O=C(COc1ccc(F)cc1)c1ccc(O)cc1O

Sugarmoiety:
CC(=O)OC1C(O)OC(O)C(OC(C)=O)C1OC(C)=O

Other Identifiers

Properties
HBA: 13 RingCount: 3
HBD: 1 FractionCSP3: 0.39
AlogP: 2.25 Num_rotatable_bonds: 11
MolWt: 592.53 Num_heavy_atoms: 42
TPSA: 170.19 NumAromaticRings: 2

Unique Aglycone
AD00017
Formula: C3H6O2

Smiles:
COC(C)=O
HBA: 2 RingCount: 0
HBD: 0 FractionCSP3: 0.67
AlogP: 0.18 Num_rotatable_bonds: 0
MolWt: 74.08 Num_heavy_atoms: 5
TPSA: 26.3 NumAromaticRings: 0
AD44512
Formula: C14H11O4F

Smiles:
O=C(COc1ccc(F)cc1)c1ccc(O)cc1O
HBA: 4 RingCount: 2
HBD: 2 FractionCSP3: 0.07
AlogP: 2.5 Num_rotatable_bonds: 4
MolWt: 262.24 Num_heavy_atoms: 19
TPSA: 66.76 NumAromaticRings: 2

Sugarmoiety
SD00012

CC(=O)OC1C(O)OC(O)C(OC(C)=O)C1OC(C)=O