Glycoside
...
GD065930

Name:
None

Formula:
C15H21O9N

Smiles:
COC(=O)CCN(Cc1ccco1)C(=O)C(=O)[C@H](O)[C@H](O)[C@H](O)CO

Aglycone:
COC(=O)CCNCc1ccco1

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

Other Identifiers

Properties
HBA: 10 RingCount: 1
HBD: 4 FractionCSP3: 0.53
AlogP: -2.18 Num_rotatable_bonds: 10
MolWt: 359.33 Num_heavy_atoms: 25
TPSA: 157.74 NumAromaticRings: 1

Unique Aglycone
AD31689
Formula: C9H13O3N

Smiles:
COC(=O)CCNCc1ccco1
HBA: 4 RingCount: 1
HBD: 1 FractionCSP3: 0.44
AlogP: 0.93 Num_rotatable_bonds: 5
MolWt: 183.21 Num_heavy_atoms: 13
TPSA: 51.47 NumAromaticRings: 1

Sugarmoiety
SD00818

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