Glycoside
...
GD101135

Name:
None

Formula:
C20H26O11N2

Smiles:
CC(=O)OC[C@H]1O[C@@H](OC(C)=O)[C@H](NC(=O)NCc2ccco2)[C@@H](OC(C)=O)[C@@H]1OC(C)=O

Aglycone:
COC(C)=O.NC(=O)NCc1ccco1

Sugarmoiety:
CC(=O)OC1OC(O)C(OC(C)=O)C(OC(C)=O)C1O

Other Identifiers

Properties
HBA: 13 RingCount: 2
HBD: 2 FractionCSP3: 0.55
AlogP: 0.16 Num_rotatable_bonds: 8
MolWt: 470.43 Num_heavy_atoms: 33
TPSA: 168.7 NumAromaticRings: 1

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
AD42745
Formula: C6H8O2N2

Smiles:
NC(=O)NCc1ccco1
HBA: 4 RingCount: 1
HBD: 3 FractionCSP3: 0.17
AlogP: 0.45 Num_rotatable_bonds: 2
MolWt: 140.14 Num_heavy_atoms: 10
TPSA: 68.26 NumAromaticRings: 1

Sugarmoiety
SD00889

CC(=O)OC1OC(O)C(OC(C)=O)C(OC(C)=O)C1O