Glycoside
...
GD098318

Name:
None

Formula:
C21H28O8N4

Smiles:
CCOC(=O)c1ccc(-c2cn(CCO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3NC(C)=O)nn2)cc1

Aglycone:
CCOC(=O)c1ccc(-c2cn(CCO)nn2)cc1

Sugarmoiety:
CC(=O)NC1C(O)OC(CO)C(O)C1O

Other Identifiers

Properties
HBA: 12 RingCount: 3
HBD: 4 FractionCSP3: 0.52
AlogP: -0.92 Num_rotatable_bonds: 9
MolWt: 464.48 Num_heavy_atoms: 33
TPSA: 165.26 NumAromaticRings: 2

Unique Aglycone
AD36557
Formula: C13H15O3N3

Smiles:
CCOC(=O)c1ccc(-c2cn(CCO)nn2)cc1
HBA: 6 RingCount: 2
HBD: 1 FractionCSP3: 0.31
AlogP: 1.11 Num_rotatable_bonds: 5
MolWt: 261.28 Num_heavy_atoms: 19
TPSA: 77.24 NumAromaticRings: 2

Sugarmoiety
SD00014

CC(=O)NC1C(O)OC(CO)C(O)C1O