Glycoside
...
GD083575

Name:
None

Formula:
C21H24O6N2

Smiles:
O=C(Nc1ccc2c(c1)CN(Cc1ccccc1)C2)C(=O)[C@H](O)[C@@H](O)[C@@H](O)CO

Aglycone:
Nc1ccc2c(c1)CN(Cc1ccccc1)C2

Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)CO

Other Identifiers

Properties
HBA: 8 RingCount: 3
HBD: 5 FractionCSP3: 0.33
AlogP: -0.21 Num_rotatable_bonds: 8
MolWt: 400.43 Num_heavy_atoms: 29
TPSA: 130.33 NumAromaticRings: 2

Unique Aglycone
AD35536
Formula: C15H16N2

Smiles:
Nc1ccc2c(c1)CN(Cc1ccccc1)C2
HBA: 2 RingCount: 3
HBD: 2 FractionCSP3: 0.2
AlogP: 2.78 Num_rotatable_bonds: 2
MolWt: 224.31 Num_heavy_atoms: 17
TPSA: 29.26 NumAromaticRings: 2

Sugarmoiety
SD00818

O=C(O)C(=O)C(O)C(O)C(O)CO