Glycoside
...
GD026970

Name:
None

Formula:
C23H27O7I

Smiles:
C=CCO[C@@H]1[C@H](O)[C@H](Oc2ccc(I)cc2)O[C@H](COCc2ccc(OC)cc2)[C@H]1O

Aglycone:
COCc1ccc(OC)cc1.Oc1ccc(I)cc1

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

Other Identifiers

Properties
HBA: 7 RingCount: 3
HBD: 2 FractionCSP3: 0.39
AlogP: 2.91 Num_rotatable_bonds: 10
MolWt: 542.37 Num_heavy_atoms: 31
TPSA: 86.61 NumAromaticRings: 2

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
AD01396
Formula: C9H12O2

Smiles:
COCc1ccc(OC)cc1
HBA: 2 RingCount: 1
HBD: 0 FractionCSP3: 0.33
AlogP: 1.84 Num_rotatable_bonds: 3
MolWt: 152.19 Num_heavy_atoms: 11
TPSA: 18.46 NumAromaticRings: 1

Sugarmoiety
SD00592

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