Glycoside
...
GD109197

Name:
None

Formula:
C32H37O13N

Smiles:
COc1cc(C(=O)NC[C@H]2OCCc3ccccc32)ccc1O[C@H]1O[C@@H](COC(C)=O)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O

Aglycone:
COC(C)=O.COc1cc(C(=O)NCC2OCCc3ccccc32)ccc1O

Sugarmoiety:
CC(=O)OC1C(O)OC(O)C(OC(C)=O)C1OC(C)=O

Other Identifiers

Properties
HBA: 14 RingCount: 4
HBD: 1 FractionCSP3: 0.47
AlogP: 2.2 Num_rotatable_bonds: 11
MolWt: 643.64 Num_heavy_atoms: 46
TPSA: 171.22 NumAromaticRings: 2

Unique Aglycone
AD00017
Formula: C3H6O2

Smiles:
COC(C)=O
HBA: 2 RingCount: 0
HBD: 0 FractionCSP3: 0.67
AlogP: 0.18 Num_rotatable_bonds: 0
MolWt: 74.08 Num_heavy_atoms: 5
TPSA: 26.3 NumAromaticRings: 0
AD44525
Formula: C18H19O4N

Smiles:
COc1cc(C(=O)NCC2OCCc3ccccc32)ccc1O
HBA: 5 RingCount: 3
HBD: 2 FractionCSP3: 0.28
AlogP: 2.44 Num_rotatable_bonds: 4
MolWt: 313.35 Num_heavy_atoms: 23
TPSA: 67.79 NumAromaticRings: 2

Sugarmoiety
SD00012

CC(=O)OC1C(O)OC(O)C(OC(C)=O)C1OC(C)=O