Glycoside
...
GD078022

Name:
None

Formula:
C18H22O7N2

Smiles:
COc1cncc(Nc2ccc(O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)cc2)c1

Aglycone:
COc1cncc(Nc2ccc(O)cc2)c1

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

Other Identifiers

Properties
HBA: 9 RingCount: 3
HBD: 5 FractionCSP3: 0.39
AlogP: 0.01 Num_rotatable_bonds: 6
MolWt: 378.38 Num_heavy_atoms: 27
TPSA: 133.53 NumAromaticRings: 2

Unique Aglycone
AD35765
Formula: C12H12O2N2

Smiles:
COc1cncc(Nc2ccc(O)cc2)c1
HBA: 4 RingCount: 2
HBD: 2 FractionCSP3: 0.08
AlogP: 2.54 Num_rotatable_bonds: 3
MolWt: 216.24 Num_heavy_atoms: 16
TPSA: 54.38 NumAromaticRings: 2

Sugarmoiety
SD00003

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