Glycoside
...
GD020118

Name:
None

Formula:
C24H24O12

Smiles:
COc1cc(C(=O)OC[C@@H]2O[C@H](Oc3ccc4ccc(=O)oc4c3)[C@H](O)[C@H](O)[C@H]2O)cc(OC)c1O

Aglycone:
COC(=O)c1cc(OC)c(O)c(OC)c1.O=c1ccc2ccc(O)cc2o1

Sugarmoiety:
OC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 12 RingCount: 4
HBD: 4 FractionCSP3: 0.33
AlogP: 0.56 Num_rotatable_bonds: 7
MolWt: 504.44 Num_heavy_atoms: 36
TPSA: 174.35 NumAromaticRings: 3

Unique Aglycone
AD00094
Formula: C10H12O5

Smiles:
COC(=O)c1cc(OC)c(O)c(OC)c1
HBA: 5 RingCount: 1
HBD: 1 FractionCSP3: 0.3
AlogP: 1.2 Num_rotatable_bonds: 3
MolWt: 212.2 Num_heavy_atoms: 15
TPSA: 64.99 NumAromaticRings: 1
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
SD00017

OC1OC(O)C(O)C(O)C1O