Glycoside
...
GD030110

Name:
None

Formula:
C16H23O11N

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)NCCO

Aglycone:
O=CNCCO

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

Other Identifiers

Properties
HBA: 12 RingCount: 1
HBD: 2 FractionCSP3: 0.69
AlogP: -1.82 Num_rotatable_bonds: 7
MolWt: 405.36 Num_heavy_atoms: 28
TPSA: 163.76 NumAromaticRings: 0

Unique Aglycone
AD03090
Formula: C3H7O2N

Smiles:
O=CNCCO
HBA: 3 RingCount: 0
HBD: 2 FractionCSP3: 0.67
AlogP: -1.28 Num_rotatable_bonds: 3
MolWt: 89.09 Num_heavy_atoms: 6
TPSA: 49.33 NumAromaticRings: 0

Sugarmoiety
SD00257

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