Glycoside
...
GD027100

Name:
None

Formula:
C17H30O9

Smiles:
O=C(CC1CCCCC1)OC[C@@H]1O[C@H](OC(CO)CO)[C@H](O)[C@H](O)[C@H]1O

Aglycone:
COC(=O)CC1CCCCC1.OCC(O)CO

Sugarmoiety:
OCC(CO)OC(O)C(O)O

Other Identifiers

Properties
HBA: 9 RingCount: 2
HBD: 5 FractionCSP3: 0.94
AlogP: -1.32 Num_rotatable_bonds: 8
MolWt: 378.42 Num_heavy_atoms: 26
TPSA: 145.91 NumAromaticRings: 0

Unique Aglycone
AD00405
Formula: C3H8O3

Smiles:
OCC(O)CO
HBA: 3 RingCount: 0
HBD: 3 FractionCSP3: 1.0
AlogP: -1.67 Num_rotatable_bonds: 2
MolWt: 92.09 Num_heavy_atoms: 6
TPSA: 60.69 NumAromaticRings: 0
AD17840
Formula: C9H16O2

Smiles:
COC(=O)CC1CCCCC1
HBA: 2 RingCount: 1
HBD: 0 FractionCSP3: 0.89
AlogP: 2.13 Num_rotatable_bonds: 2
MolWt: 156.22 Num_heavy_atoms: 11
TPSA: 26.3 NumAromaticRings: 0

Sugarmoiety
SD01952

OCC(CO)OC(O)C(O)O