Glycoside
...
GD035934

Name:
None

Formula:
C23H38O17N

Smiles:
CC(=O)N[C@@H]1[C@H](O)C[C@](O[C@H]2[C@H](O)[C@@H](O[C@@H]3CCO[C@H](CO)[C@H]3O)O[C@@H](CO)[C@H]2O)(C(=O)[O-])O[C@H]1[C@H](O)[C@H](O)CO

Aglycone:
CC(=O)NC1C(O)CC(O)(C(=O)[O-])OC1C(O)C(O)CO.OCC1OCCC(O)C1O

Sugarmoiety:
OCC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 18 RingCount: 3
HBD: 10 FractionCSP3: 0.91
AlogP: -7.85 Num_rotatable_bonds: 11
MolWt: 600.55 Num_heavy_atoms: 41
TPSA: 297.45 NumAromaticRings: 0

Unique Aglycone
AD00303
Formula: C11H18O9N

Smiles:
CC(=O)NC1C(O)CC(O)(C(=O)[O-])OC1C(O)C(O)CO
HBA: 10 RingCount: 1
HBD: 6 FractionCSP3: 0.82
AlogP: -5.21 Num_rotatable_bonds: 5
MolWt: 308.26 Num_heavy_atoms: 21
TPSA: 179.61 NumAromaticRings: 0
AD02704
Formula: C6H12O4

Smiles:
OCC1OCCC(O)C1O
HBA: 4 RingCount: 1
HBD: 3 FractionCSP3: 1.0
AlogP: -1.51 Num_rotatable_bonds: 1
MolWt: 148.16 Num_heavy_atoms: 10
TPSA: 69.92 NumAromaticRings: 0

Sugarmoiety
SD00003

OCC1OC(O)C(O)C(O)C1O