Glycoside
...
GD033933

Name:
None

Formula:
C28H28O8

Smiles:
COc1ccc(-c2cccc3ccccc23)cc1[C@@H]1O[C@H](COC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O

Aglycone:
COC(C)=O.COc1ccc(-c2cccc3ccccc23)cc1

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

Other Identifiers

Properties
HBA: 8 RingCount: 4
HBD: 0 FractionCSP3: 0.32
AlogP: 4.38 Num_rotatable_bonds: 7
MolWt: 492.52 Num_heavy_atoms: 36
TPSA: 97.36 NumAromaticRings: 3

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
AD06093
Formula: C17H14O

Smiles:
COc1ccc(-c2cccc3ccccc23)cc1
HBA: 1 RingCount: 3
HBD: 0 FractionCSP3: 0.06
AlogP: 4.52 Num_rotatable_bonds: 2
MolWt: 234.3 Num_heavy_atoms: 18
TPSA: 9.23 NumAromaticRings: 3

Sugarmoiety
SD00105

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