Glycoside
...
GD031943

Name:
None

Formula:
C26H25O7I

Smiles:
C=CCO[C@@H]1[C@H](O)[C@H](Oc2ccc(I)cc2)O[C@H](COC(=O)c2ccc3ccccc3c2)[C@H]1O

Aglycone:
COC(=O)c1ccc2ccccc2c1.Oc1ccc(I)cc1

Sugarmoiety:
C=CCOC1C(O)C(O)OC(O)C1O

Other Identifiers

Properties
HBA: 7 RingCount: 4
HBD: 2 FractionCSP3: 0.27
AlogP: 3.7 Num_rotatable_bonds: 8
MolWt: 576.38 Num_heavy_atoms: 34
TPSA: 94.45 NumAromaticRings: 3

Unique Aglycone
AD01382
Formula: C6H5OI

Smiles:
Oc1ccc(I)cc1
HBA: 1 RingCount: 1
HBD: 1 FractionCSP3: 0.0
AlogP: 2.0 Num_rotatable_bonds: 0
MolWt: 220.01 Num_heavy_atoms: 8
TPSA: 20.23 NumAromaticRings: 1
AD14655
Formula: C12H10O2

Smiles:
COC(=O)c1ccc2ccccc2c1
HBA: 2 RingCount: 2
HBD: 0 FractionCSP3: 0.08
AlogP: 2.63 Num_rotatable_bonds: 1
MolWt: 186.21 Num_heavy_atoms: 14
TPSA: 26.3 NumAromaticRings: 2

Sugarmoiety
SD00592

C=CCOC1C(O)C(O)OC(O)C1O