Glycoside
...
GD015167

Name:
Pieceid-2''-O-Gallate

Formula:
C27H26O12

Smiles:
O=C(O[C@H]1[C@H](Oc2cc(O)cc(C=Cc3ccc(O)cc3)c2)O[C@@H](CO)[C@@H](O)[C@H]1O)c1cc(O)c(O)c(O)c1

Aglycone:
O=C(O)c1cc(O)c(O)c(O)c1.Oc1ccc(C=Cc2cc(O)cc(O)c2)cc1

Sugarmoiety:
OCC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 12 RingCount: 4
HBD: 8 FractionCSP3: 0.22
AlogP: 1.43 Num_rotatable_bonds: 7
MolWt: 542.49 Num_heavy_atoms: 39
TPSA: 206.6 NumAromaticRings: 3

Unique Aglycone
AD00518
Formula: C7H6O5

Smiles:
O=C(O)c1cc(O)c(O)c(O)c1
HBA: 5 RingCount: 1
HBD: 4 FractionCSP3: 0.0
AlogP: 0.5 Num_rotatable_bonds: 1
MolWt: 170.12 Num_heavy_atoms: 12
TPSA: 97.99 NumAromaticRings: 1
AD01773
Formula: C14H12O3

Smiles:
Oc1ccc(C=Cc2cc(O)cc(O)c2)cc1
HBA: 3 RingCount: 2
HBD: 3 FractionCSP3: 0.0
AlogP: 2.97 Num_rotatable_bonds: 2
MolWt: 228.25 Num_heavy_atoms: 17
TPSA: 60.69 NumAromaticRings: 2

Sugarmoiety
SD00003

OCC1OC(O)C(O)C(O)C1O