Glycoside
...
GD065922

Name:
None

Formula:
C17H21O7N

Smiles:
CC(=O)c1ccc2c(c1)CN(C(=O)C(=O)[C@H](O)[C@H](O)[C@H](O)CO)CC2

Aglycone:
CC(=O)c1ccc2c(c1)CNCC2

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

Other Identifiers

Properties
HBA: 8 RingCount: 2
HBD: 4 FractionCSP3: 0.47
AlogP: -1.58 Num_rotatable_bonds: 6
MolWt: 351.36 Num_heavy_atoms: 25
TPSA: 135.37 NumAromaticRings: 1

Unique Aglycone
AD31686
Formula: C11H13ON

Smiles:
CC(=O)c1ccc2c(c1)CNCC2
HBA: 2 RingCount: 2
HBD: 1 FractionCSP3: 0.36
AlogP: 1.53 Num_rotatable_bonds: 1
MolWt: 175.23 Num_heavy_atoms: 13
TPSA: 29.1 NumAromaticRings: 1

Sugarmoiety
SD00818

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