Glycoside
...
GD010991

Name:
None

Formula:
C22H27O11N

Smiles:
CC(=O)O[C@H]1[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H](OC(C)=O)O[C@H]1C(=O)N[C@H](CO)c1ccccc1

Aglycone:
O=CNC(CO)c1ccccc1

Sugarmoiety:
CC(=O)OC1OC(O)C(OC(C)=O)C(OC(C)=O)C1OC(C)=O

Other Identifiers

Properties
HBA: 12 RingCount: 2
HBD: 2 FractionCSP3: 0.5
AlogP: -0.08 Num_rotatable_bonds: 8
MolWt: 481.45 Num_heavy_atoms: 34
TPSA: 163.76 NumAromaticRings: 1

Unique Aglycone
AD08427
Formula: C9H11O2N

Smiles:
O=CNC(CO)c1ccccc1
HBA: 3 RingCount: 1
HBD: 2 FractionCSP3: 0.22
AlogP: 0.47 Num_rotatable_bonds: 4
MolWt: 165.19 Num_heavy_atoms: 12
TPSA: 49.33 NumAromaticRings: 1

Sugarmoiety
SD00257

CC(=O)OC1OC(O)C(OC(C)=O)C(OC(C)=O)C1OC(C)=O