Glycoside
...
GD078068

Name:
None

Formula:
C18H25O6N3

Smiles:
CCCn1cc(Nc2ccc(O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)cc2)cn1

Aglycone:
CCCn1cc(Nc2ccc(O)cc2)cn1

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

Other Identifiers

Properties
HBA: 9 RingCount: 3
HBD: 5 FractionCSP3: 0.5
AlogP: 0.22 Num_rotatable_bonds: 7
MolWt: 379.41 Num_heavy_atoms: 27
TPSA: 129.23 NumAromaticRings: 2

Unique Aglycone
AD35789
Formula: C12H15ON3

Smiles:
CCCn1cc(Nc2ccc(O)cc2)cn1
HBA: 4 RingCount: 2
HBD: 2 FractionCSP3: 0.25
AlogP: 2.74 Num_rotatable_bonds: 4
MolWt: 217.27 Num_heavy_atoms: 16
TPSA: 50.08 NumAromaticRings: 2

Sugarmoiety
SD00003

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