Glycoside
...
GD100124

Name:
None

Formula:
C22H22O12

Smiles:
COC(=O)[C@@H]1O[C@H](Oc2ccc3ccc(=O)oc3c2)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O

Aglycone:
O=c1ccc2ccc(O)cc2o1

Sugarmoiety:
COC(=O)C1OC(O)C(OC(C)=O)C(OC(C)=O)C1OC(C)=O

Other Identifiers

Properties
HBA: 12 RingCount: 3
HBD: 0 FractionCSP3: 0.41
AlogP: 0.86 Num_rotatable_bonds: 6
MolWt: 478.41 Num_heavy_atoms: 34
TPSA: 153.87 NumAromaticRings: 2

Unique Aglycone
AD07479
Formula: C9H6O3

Smiles:
O=c1ccc2ccc(O)cc2o1
HBA: 3 RingCount: 2
HBD: 1 FractionCSP3: 0.0
AlogP: 1.5 Num_rotatable_bonds: 0
MolWt: 162.14 Num_heavy_atoms: 12
TPSA: 50.44 NumAromaticRings: 2

Sugarmoiety
SD00268

COC(=O)C1OC(O)C(OC(C)=O)C(OC(C)=O)C1OC(C)=O