Glycoside
...
GD127150

Name:
[4,5-bis(acetyloxy)-3-({2-[4-(acetyloxy)phenyl]acetyl}oxy)-6-[(5-oxooxolan-3-yl)oxy]oxan-2-yl]methyl acetate

Formula:
C26H30O14

Smiles:
CC(=O)OCC1OC(OC2COC(=O)C2)C(OC(C)=O)C(OC(C)=O)C1OC(=O)Cc1ccc(OC(C)=O)cc1

Aglycone:
CC(=O)Oc1ccc(CC(=O)O)cc1.COC(C)=O.O=C1CC(O)CO1

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

Other Identifiers

Properties
HBA: 14 RingCount: 3
HBD: 0 FractionCSP3: 0.54
AlogP: 0.55 Num_rotatable_bonds: 10
MolWt: 566.51 Num_heavy_atoms: 40
TPSA: 176.26 NumAromaticRings: 1

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
AD05359
Formula: C4H6O3

Smiles:
O=C1CC(O)CO1
HBA: 3 RingCount: 1
HBD: 1 FractionCSP3: 0.75
AlogP: -0.71 Num_rotatable_bonds: 0
MolWt: 102.09 Num_heavy_atoms: 7
TPSA: 46.53 NumAromaticRings: 0
AD51479
Formula: C10H10O4

Smiles:
CC(=O)Oc1ccc(CC(=O)O)cc1
HBA: 4 RingCount: 1
HBD: 1 FractionCSP3: 0.2
AlogP: 1.24 Num_rotatable_bonds: 3
MolWt: 194.19 Num_heavy_atoms: 14
TPSA: 63.6 NumAromaticRings: 1

Sugarmoiety
SD00013

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