Glycoside
...
GD093222

Name:
None

Formula:
C24H20O7N2

Smiles:
O=C(O[C@H](C(=O)NCc1ccccn1)[C@@H](OC(=O)c1ccccc1)C(=O)O)c1ccccc1

Aglycone:
NCc1ccccn1.O=Cc1ccccc1.O=Cc1ccccc1

Sugarmoiety:
O=C(O)C(OO)C(OO)C(=O)O

Other Identifiers

Properties
HBA: 9 RingCount: 3
HBD: 2 FractionCSP3: 0.12
AlogP: 2.23 Num_rotatable_bonds: 9
MolWt: 448.43 Num_heavy_atoms: 33
TPSA: 131.89 NumAromaticRings: 3

Unique Aglycone
AD01696
Formula: C7H6O

Smiles:
O=Cc1ccccc1
HBA: 1 RingCount: 1
HBD: 0 FractionCSP3: 0.0
AlogP: 1.5 Num_rotatable_bonds: 1
MolWt: 106.12 Num_heavy_atoms: 8
TPSA: 17.07 NumAromaticRings: 1
AD15385
Formula: C6H8N2

Smiles:
NCc1ccccn1
HBA: 2 RingCount: 1
HBD: 2 FractionCSP3: 0.17
AlogP: 0.54 Num_rotatable_bonds: 1
MolWt: 108.14 Num_heavy_atoms: 8
TPSA: 38.91 NumAromaticRings: 1

Sugarmoiety
SD00296

O=C(O)C(OO)C(OO)C(=O)O