Glycoside
...
GD101486

Name:
None

Formula:
C19H23O10N4Cl

Smiles:
COc1nc(Cl)nnc1N[C@H]1[C@H](OC(C)=O)O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O

Aglycone:
COC(C)=O.COc1nc(Cl)nnc1N

Sugarmoiety:
CC(=O)OCC1OOC(O)C(OC(C)=O)C1OC(C)=O

Other Identifiers

Properties
HBA: 14 RingCount: 2
HBD: 1 FractionCSP3: 0.61
AlogP: 0.03 Num_rotatable_bonds: 8
MolWt: 490.85 Num_heavy_atoms: 33
TPSA: 174.36 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
AD25695
Formula: C5H5ON4Cl

Smiles:
COc1nc(Cl)nnc1N
HBA: 5 RingCount: 1
HBD: 2 FractionCSP3: 0.25
AlogP: 0.12 Num_rotatable_bonds: 1
MolWt: 160.56 Num_heavy_atoms: 10
TPSA: 73.92 NumAromaticRings: 1

Sugarmoiety
SD00215

CC(=O)OCC1OOC(O)C(OC(C)=O)C1OC(C)=O