Glycoside
...
GD050671

Name:
None

Formula:
C14H25O6N2

Smiles:
C=CC[N@H+]1CCC[C@H]1CNC(=O)C(=O)[C@H](O)[C@@H](O)[C@@H](O)CO

Aglycone:
C=CC[NH+]1CCCC1CN

Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)CO

Other Identifiers

Properties
HBA: 8 RingCount: 1
HBD: 6 FractionCSP3: 0.71
AlogP: -4.02 Num_rotatable_bonds: 9
MolWt: 317.36 Num_heavy_atoms: 22
TPSA: 131.53 NumAromaticRings: 0

Unique Aglycone
AD26688
Formula: C8H17N2

Smiles:
C=CC[NH+]1CCCC1CN
HBA: 2 RingCount: 1
HBD: 3 FractionCSP3: 0.75
AlogP: -0.82 Num_rotatable_bonds: 3
MolWt: 141.24 Num_heavy_atoms: 10
TPSA: 30.46 NumAromaticRings: 0

Sugarmoiety
SD00818

O=C(O)C(=O)C(O)C(O)C(O)CO