Glycoside
...
GD010184

Name:
None

Formula:
C23H25O8I

Smiles:
C=CCO[C@@H]1[C@H](O)[C@H](Oc2ccc(I)cc2)O[C@H](COC(=O)c2ccc(OC)cc2)[C@H]1O

Aglycone:
COC(=O)c1ccc(OC)cc1.Oc1ccc(I)cc1

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

Other Identifiers

Properties
HBA: 8 RingCount: 3
HBD: 2 FractionCSP3: 0.35
AlogP: 2.55 Num_rotatable_bonds: 9
MolWt: 556.35 Num_heavy_atoms: 32
TPSA: 103.68 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
AD02530
Formula: C9H10O3

Smiles:
COC(=O)c1ccc(OC)cc1
HBA: 3 RingCount: 1
HBD: 0 FractionCSP3: 0.22
AlogP: 1.48 Num_rotatable_bonds: 2
MolWt: 166.18 Num_heavy_atoms: 12
TPSA: 35.53 NumAromaticRings: 1

Sugarmoiety
SD00592

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