Glycoside
...
GD012592

Name:
None

Formula:
C17H25O8N

Smiles:
COc1cc(CO[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2NC(C)=O)cc(OC)c1

Aglycone:
COc1cc(CO)cc(OC)c1

Sugarmoiety:
CC(=O)NC1C(O)OC(CO)C(O)C1O

Other Identifiers

Properties
HBA: 9 RingCount: 2
HBD: 4 FractionCSP3: 0.59
AlogP: -0.84 Num_rotatable_bonds: 7
MolWt: 371.39 Num_heavy_atoms: 26
TPSA: 126.71 NumAromaticRings: 1

Unique Aglycone
AD09484
Formula: C9H12O3

Smiles:
COc1cc(CO)cc(OC)c1
HBA: 3 RingCount: 1
HBD: 1 FractionCSP3: 0.33
AlogP: 1.2 Num_rotatable_bonds: 3
MolWt: 168.19 Num_heavy_atoms: 12
TPSA: 38.69 NumAromaticRings: 1

Sugarmoiety
SD00014

CC(=O)NC1C(O)OC(CO)C(O)C1O