Glycoside
...
GD113156

Name:
None

Formula:
C47H40O9

Smiles:
CO[C@@H]1O[C@H](COC(c2ccccc2)(c2ccccc2)c2ccccc2)[C@@H](OC(=O)c2ccccc2)[C@@H](OC(=O)c2ccccc2)[C@@H]1OC(=O)c1ccccc1

Aglycone:
COC(c1ccccc1)(c1ccccc1)c1ccccc1.O=C(O)c1ccccc1.O=C(O)c1ccccc1.O=C(O)c1ccccc1

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

Other Identifiers

Properties
HBA: 9 RingCount: 7
HBD: 0 FractionCSP3: 0.17
AlogP: 8.04 Num_rotatable_bonds: 13
MolWt: 748.83 Num_heavy_atoms: 56
TPSA: 106.59 NumAromaticRings: 6

Unique Aglycone
AD00002
Formula: C7H6O2

Smiles:
O=C(O)c1ccccc1
HBA: 2 RingCount: 1
HBD: 1 FractionCSP3: 0.0
AlogP: 1.38 Num_rotatable_bonds: 1
MolWt: 122.12 Num_heavy_atoms: 9
TPSA: 37.3 NumAromaticRings: 1
AD01054
Formula: C20H18O

Smiles:
COC(c1ccccc1)(c1ccccc1)c1ccccc1
HBA: 1 RingCount: 3
HBD: 0 FractionCSP3: 0.1
AlogP: 4.62 Num_rotatable_bonds: 4
MolWt: 274.36 Num_heavy_atoms: 21
TPSA: 9.23 NumAromaticRings: 3

Sugarmoiety
SD00009

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