Glycoside
...
GD098134

Name:
None

Formula:
C17H20O7N3Br

Smiles:
O[C@H]1[C@@H](O)[C@@H](c2nc(-c3cc(Br)cc(N4CCOCC4)c3)no2)O[C@@H](O)[C@@H]1O

Aglycone:
Brc1cc(-c2ncon2)cc(N2CCOCC2)c1

Sugarmoiety:
OC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 10 RingCount: 4
HBD: 4 FractionCSP3: 0.53
AlogP: -0.19 Num_rotatable_bonds: 3
MolWt: 458.27 Num_heavy_atoms: 28
TPSA: 141.54 NumAromaticRings: 2

Unique Aglycone
AD41752
Formula: C12H12O2N3Br

Smiles:
Brc1cc(-c2ncon2)cc(N2CCOCC2)c1
HBA: 5 RingCount: 3
HBD: 0 FractionCSP3: 0.33
AlogP: 2.34 Num_rotatable_bonds: 2
MolWt: 310.15 Num_heavy_atoms: 18
TPSA: 51.39 NumAromaticRings: 2

Sugarmoiety
SD00017

OC1OC(O)C(O)C(O)C1O