Glycoside
...
GD116905

Name:
None

Formula:
C28H32O15

Smiles:
COc1ccc(-c2cc(=O)c3c(O)c(C4OC(CO)C(O)C(OC5OC(CO)C(O)C(O)C5O)C4O)c(O)cc3o2)cc1

Aglycone:
COc1ccc(-c2cc(=O)c3c(O)cc(O)cc3o2)cc1

Sugarmoiety:
OCC1OC(OC2C(O)C(O)OC(CO)C2O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 15 RingCount: 5
HBD: 9 FractionCSP3: 0.46
AlogP: -1.78 Num_rotatable_bonds: 7
MolWt: 608.55 Num_heavy_atoms: 43
TPSA: 249.2 NumAromaticRings: 3

Unique Aglycone
AD02166
Formula: C16H12O5

Smiles:
COc1ccc(-c2cc(=O)c3c(O)cc(O)cc3o2)cc1
HBA: 5 RingCount: 3
HBD: 2 FractionCSP3: 0.06
AlogP: 2.88 Num_rotatable_bonds: 2
MolWt: 284.27 Num_heavy_atoms: 21
TPSA: 79.9 NumAromaticRings: 3

Sugarmoiety
SD00746

OCC1OC(OC2C(O)C(O)OC(CO)C2O)C(O)C(O)C1O