Glycoside
...
GD109641

Name:
None

Formula:
C25H43O10N

Smiles:
CCCCCCCCCCO[C@@H]1O[C@H](COC(C)=O)[C@H](OC(C)=O)[C@H](OCC(=O)OC)[C@H]1NC(C)=O

Aglycone:
CCCCCCCCCCO.COC(=O)CO.COC(C)=O

Sugarmoiety:
CC(=O)NC1C(O)OC(O)C(OC(C)=O)C1O

Other Identifiers

Properties
HBA: 11 RingCount: 1
HBD: 1 FractionCSP3: 0.84
AlogP: 2.43 Num_rotatable_bonds: 17
MolWt: 517.62 Num_heavy_atoms: 36
TPSA: 135.69 NumAromaticRings: 0

Unique Aglycone
AD00017
Formula: C3H6O2

Smiles:
COC(C)=O
HBA: 2 RingCount: 0
HBD: 0 FractionCSP3: 0.67
AlogP: 0.18 Num_rotatable_bonds: 0
MolWt: 74.08 Num_heavy_atoms: 5
TPSA: 26.3 NumAromaticRings: 0
AD00651
Formula: C10H22O

Smiles:
CCCCCCCCCCO
HBA: 1 RingCount: 0
HBD: 1 FractionCSP3: 1.0
AlogP: 3.12 Num_rotatable_bonds: 8
MolWt: 158.28 Num_heavy_atoms: 11
TPSA: 20.23 NumAromaticRings: 0
AD09952
Formula: C3H6O3

Smiles:
COC(=O)CO
HBA: 3 RingCount: 0
HBD: 1 FractionCSP3: 0.67
AlogP: -0.85 Num_rotatable_bonds: 1
MolWt: 90.08 Num_heavy_atoms: 6
TPSA: 46.53 NumAromaticRings: 0

Sugarmoiety
SD01906

CC(=O)NC1C(O)OC(O)C(OC(C)=O)C1O