Glycoside
...
GD015544

Name:
None

Formula:
C24H27O11N

Smiles:
COc1ccc(-c2c(O)ccn([C@@H]3O[C@H](COC(C)=O)[C@H](OC(C)=O)[C@H]3OC(C)=O)c2=O)cc1OC

Aglycone:
COC(C)=O.COc1ccc(-c2c(O)cc[nH]c2=O)cc1OC

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

Other Identifiers

Properties
HBA: 12 RingCount: 3
HBD: 1 FractionCSP3: 0.42
AlogP: 1.56 Num_rotatable_bonds: 8
MolWt: 505.48 Num_heavy_atoms: 36
TPSA: 148.82 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
AD11284
Formula: C13H13O4N

Smiles:
COc1ccc(-c2c(O)cc[nH]c2=O)cc1OC
HBA: 5 RingCount: 2
HBD: 2 FractionCSP3: 0.15
AlogP: 1.76 Num_rotatable_bonds: 3
MolWt: 247.25 Num_heavy_atoms: 18
TPSA: 71.55 NumAromaticRings: 2

Sugarmoiety
SD00105

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