Glycoside
...
GD105030

Name:
None

Formula:
C24H32O10

Smiles:
CC(=O)OC[C@@H]1O[C@H](Oc2cc(C(C)C)ccc2C)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O

Aglycone:
COC(C)=O.Cc1ccc(C(C)C)cc1O

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

Other Identifiers

Properties
HBA: 10 RingCount: 2
HBD: 0 FractionCSP3: 0.58
AlogP: 2.58 Num_rotatable_bonds: 8
MolWt: 480.51 Num_heavy_atoms: 34
TPSA: 123.66 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
AD44034
Formula: C10H14O

Smiles:
Cc1ccc(C(C)C)cc1O
HBA: 1 RingCount: 1
HBD: 1 FractionCSP3: 0.4
AlogP: 2.82 Num_rotatable_bonds: 1
MolWt: 150.22 Num_heavy_atoms: 11
TPSA: 20.23 NumAromaticRings: 1

Sugarmoiety
SD00012

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