Glycoside
...
GD108767

Name:
[3,4,5-tris(acetyloxy)-6-[(3-methyl-1,4-dioxo-1,4-dihydronaphthalen-2-yl)oxy]oxan-2-yl]methyl acetate

Formula:
C25H26O12

Smiles:
CC(=O)OC[C@H]1O[C@@H](OC2=C(C)C(=O)c3ccccc3C2=O)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O

Aglycone:
CC1=C(O)C(=O)c2ccccc2C1=O.COC(C)=O

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

Other Identifiers

Properties
HBA: 12 RingCount: 3
HBD: 0 FractionCSP3: 0.44
AlogP: 1.44 Num_rotatable_bonds: 7
MolWt: 518.47 Num_heavy_atoms: 37
TPSA: 157.8 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
AD44330
Formula: C11H8O3

Smiles:
CC1=C(O)C(=O)c2ccccc2C1=O
HBA: 3 RingCount: 2
HBD: 1 FractionCSP3: 0.09
AlogP: 1.9 Num_rotatable_bonds: 0
MolWt: 188.18 Num_heavy_atoms: 14
TPSA: 54.37 NumAromaticRings: 1

Sugarmoiety
SD00012

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