Glycoside
...
GD158043

Name:
[5-(acetyloxy)-3,4-dihydroxy-6-[(3-methylbutanoyl)oxy]oxan-2-yl]methyl 2-methylbut-2-enoate

Formula:
C18H28O9

Smiles:
CC=C(C)C(=O)OCC1OC(OC(=O)CC(C)C)C(OC(C)=O)C(O)C1O

Aglycone:
CC(C)CC(=O)O.CC=C(C)C(=O)OC

Sugarmoiety:
CC(=O)OC1C(O)OC(O)C(O)C1O

Other Identifiers

Properties
HBA: 9 RingCount: 1
HBD: 2 FractionCSP3: 0.72
AlogP: 0.46 Num_rotatable_bonds: 7
MolWt: 388.41 Num_heavy_atoms: 27
TPSA: 128.59 NumAromaticRings: 0

Unique Aglycone
AD00281
Formula: C5H10O2

Smiles:
CC(C)CC(=O)O
HBA: 2 RingCount: 0
HBD: 1 FractionCSP3: 0.8
AlogP: 1.12 Num_rotatable_bonds: 2
MolWt: 102.13 Num_heavy_atoms: 7
TPSA: 37.3 NumAromaticRings: 0
AD45418
Formula: C6H10O2

Smiles:
CC=C(C)C(=O)OC
HBA: 2 RingCount: 0
HBD: 0 FractionCSP3: 0.5
AlogP: 1.13 Num_rotatable_bonds: 1
MolWt: 114.14 Num_heavy_atoms: 8
TPSA: 26.3 NumAromaticRings: 0

Sugarmoiety
SD00776

CC(=O)OC1C(O)OC(O)C(O)C1O