Glycoside
...
GD024396

Name:
KHAINAOSIDE C

Formula:
C25H28O11

Smiles:
COc1cc(C=CCO)ccc1O[C@@H]1O[C@H](COC(=O)C=Cc2ccc(O)c(O)c2)[C@H](O)[C@H](O)[C@H]1O

Aglycone:
COC(=O)C=Cc1ccc(O)c(O)c1.COc1cc(C=CCO)ccc1O

Sugarmoiety:
OC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 11 RingCount: 3
HBD: 6 FractionCSP3: 0.32
AlogP: 0.55 Num_rotatable_bonds: 9
MolWt: 504.49 Num_heavy_atoms: 36
TPSA: 175.37 NumAromaticRings: 2

Unique Aglycone
AD03431
Formula: C10H10O4

Smiles:
COC(=O)C=Cc1ccc(O)c(O)c1
HBA: 4 RingCount: 1
HBD: 2 FractionCSP3: 0.1
AlogP: 1.28 Num_rotatable_bonds: 2
MolWt: 194.19 Num_heavy_atoms: 14
TPSA: 66.76 NumAromaticRings: 1
AD05908
Formula: C10H12O3

Smiles:
COc1cc(C=CCO)ccc1O
HBA: 3 RingCount: 1
HBD: 2 FractionCSP3: 0.2
AlogP: 1.41 Num_rotatable_bonds: 3
MolWt: 180.2 Num_heavy_atoms: 13
TPSA: 49.69 NumAromaticRings: 1

Sugarmoiety
SD00017

OC1OC(O)C(O)C(O)C1O