Glycoside
...
GD093692

Name:
None

Formula:
C20H35O11N2

Smiles:
CC(=O)N[C@@H]1[C@H](OCCOCCOCC[NH3+])O[C@@H](COC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O

Aglycone:
COC(C)=O.[NH3+]CCOCCOCCO

Sugarmoiety:
CC(=O)NC1C(O)OC(O)C(OC(C)=O)C1OC(C)=O

Other Identifiers

Properties
HBA: 13 RingCount: 1
HBD: 4 FractionCSP3: 0.8
AlogP: -2.07 Num_rotatable_bonds: 14
MolWt: 479.5 Num_heavy_atoms: 33
TPSA: 172.56 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
AD40443
Formula: C6H16O3N

Smiles:
[NH3+]CCOCCOCCO
HBA: 4 RingCount: 0
HBD: 4 FractionCSP3: 1.0
AlogP: -1.75 Num_rotatable_bonds: 7
MolWt: 150.2 Num_heavy_atoms: 10
TPSA: 66.33 NumAromaticRings: 0

Sugarmoiety
SD00131

CC(=O)NC1C(O)OC(O)C(OC(C)=O)C1OC(C)=O