Glycoside
...
GD091861

Name:
None

Formula:
C19H22O7N3Cl

Smiles:
COc1ccc(COc2nc(Cl)ncc2N[C@H]2[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)cc1

Aglycone:
COc1ccc(COc2nc(Cl)ncc2N)cc1

Sugarmoiety:
OCC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 10 RingCount: 3
HBD: 5 FractionCSP3: 0.44
AlogP: -0.07 Num_rotatable_bonds: 7
MolWt: 427.84 Num_heavy_atoms: 29
TPSA: 146.42 NumAromaticRings: 2

Unique Aglycone
AD40061
Formula: C13H12O2N3Cl

Smiles:
COc1ccc(COc2nc(Cl)ncc2N)cc1
HBA: 5 RingCount: 2
HBD: 2 FractionCSP3: 0.17
AlogP: 2.3 Num_rotatable_bonds: 4
MolWt: 265.7 Num_heavy_atoms: 18
TPSA: 70.26 NumAromaticRings: 2

Sugarmoiety
SD00003

OCC1OC(O)C(O)C(O)C1O