Glycoside
...
GD082966

Name:
None

Formula:
C18H27O10N

Smiles:
CCCC(=O)N[C@@H]1[C@H](OC(C)=O)O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O

Aglycone:
CCCC(N)=O.COC(C)=O

Sugarmoiety:
CC(=O)OCC1OOC(O)C(OC(C)=O)C1OC(C)=O

Other Identifiers

Properties
HBA: 11 RingCount: 1
HBD: 1 FractionCSP3: 0.72
AlogP: -0.01 Num_rotatable_bonds: 8
MolWt: 417.41 Num_heavy_atoms: 29
TPSA: 143.53 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
AD04242
Formula: C4H9ON

Smiles:
CCCC(N)=O
HBA: 2 RingCount: 0
HBD: 2 FractionCSP3: 0.75
AlogP: 0.27 Num_rotatable_bonds: 2
MolWt: 87.12 Num_heavy_atoms: 6
TPSA: 43.09 NumAromaticRings: 0

Sugarmoiety
SD00215

CC(=O)OCC1OOC(O)C(OC(C)=O)C1OC(C)=O