Glycoside
...
GD107851

Name:
None

Formula:
C26H29O11N

Smiles:
COC(=O)c1ccc2ccccc2c1O[C@@H]1O[C@H](COC(C)=O)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1NC(C)=O

Aglycone:
COC(=O)c1ccc2ccccc2c1O.COC(C)=O

Sugarmoiety:
CC(=O)NC1C(O)OC(O)C(OC(C)=O)C1OC(C)=O

Other Identifiers

Properties
HBA: 12 RingCount: 3
HBD: 1 FractionCSP3: 0.42
AlogP: 1.66 Num_rotatable_bonds: 8
MolWt: 531.51 Num_heavy_atoms: 38
TPSA: 152.76 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
AD14591
Formula: C12H10O3

Smiles:
COC(=O)c1ccc2ccccc2c1O
HBA: 3 RingCount: 2
HBD: 1 FractionCSP3: 0.08
AlogP: 2.33 Num_rotatable_bonds: 1
MolWt: 202.21 Num_heavy_atoms: 15
TPSA: 46.53 NumAromaticRings: 2

Sugarmoiety
SD00131

CC(=O)NC1C(O)OC(O)C(OC(C)=O)C1OC(C)=O