Glycoside
...
GD019043

Name:
None

Formula:
C27H36O9

Smiles:
COc1cc(OC)cc(OC[C@@H]2O[C@H](OC)[C@H](Oc3ccc(OC4CCCCC4)cc3)[C@H](O)[C@H]2O)c1

Aglycone:
COc1cc(OC)cc(OC)c1.Oc1ccc(OC2CCCCC2)cc1

Sugarmoiety:
COC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 9 RingCount: 4
HBD: 2 FractionCSP3: 0.56
AlogP: 3.33 Num_rotatable_bonds: 10
MolWt: 504.58 Num_heavy_atoms: 36
TPSA: 105.07 NumAromaticRings: 2

Unique Aglycone
AD00645
Formula: C12H16O2

Smiles:
Oc1ccc(OC2CCCCC2)cc1
HBA: 2 RingCount: 2
HBD: 1 FractionCSP3: 0.5
AlogP: 3.1 Num_rotatable_bonds: 2
MolWt: 192.26 Num_heavy_atoms: 14
TPSA: 29.46 NumAromaticRings: 1
AD09704
Formula: C9H12O3

Smiles:
COc1cc(OC)cc(OC)c1
HBA: 3 RingCount: 1
HBD: 0 FractionCSP3: 0.33
AlogP: 1.71 Num_rotatable_bonds: 3
MolWt: 168.19 Num_heavy_atoms: 12
TPSA: 27.69 NumAromaticRings: 1

Sugarmoiety
SD00009

COC1OC(O)C(O)C(O)C1O