Glycoside
...
GD001618

Name:
None

Formula:
C42H60O19

Smiles:
CCCCCCCC(=O)OC[C@@H]1O[C@H](O[C@@H]2[C@H](CO)O[C@H](O[C@@H]3[C@H](CO)O[C@H](Oc4ccc(C=Cc5cc(OC)cc(OC)c5)cc4)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O

Aglycone:
CCCCCCCC(=O)OC.COc1cc(C=Cc2ccc(O)cc2)cc(OC)c1

Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OC1OC(CO)C(OC2OC(O)C(O)C(O)C2O)C(O)C1O

Other Identifiers

Properties
HBA: 19 RingCount: 5
HBD: 9 FractionCSP3: 0.64
AlogP: -0.39 Num_rotatable_bonds: 20
MolWt: 868.92 Num_heavy_atoms: 61
TPSA: 282.21 NumAromaticRings: 2

Unique Aglycone
AD01167
Formula: C16H16O3

Smiles:
COc1cc(C=Cc2ccc(O)cc2)cc(OC)c1
HBA: 3 RingCount: 2
HBD: 1 FractionCSP3: 0.12
AlogP: 3.58 Num_rotatable_bonds: 4
MolWt: 256.3 Num_heavy_atoms: 19
TPSA: 38.69 NumAromaticRings: 2
AD01605
Formula: C9H18O2

Smiles:
CCCCCCCC(=O)OC
HBA: 2 RingCount: 0
HBD: 0 FractionCSP3: 0.89
AlogP: 2.52 Num_rotatable_bonds: 6
MolWt: 158.24 Num_heavy_atoms: 11
TPSA: 26.3 NumAromaticRings: 0

Sugarmoiety
SD00413

OCC1OC(O)C(O)C(O)C1OC1OC(CO)C(OC2OC(O)C(O)C(O)C2O)C(O)C1O