Glycoside
...
GD081027

Name:
None

Formula:
C18H25O6N5

Smiles:
CC(=O)N[C@H]1[C@H](OCCn2cc(-c3ccc(C)cn3)nn2)O[C@H](CO)[C@@H](O)[C@@H]1O

Aglycone:
Cc1ccc(-c2cn(CCO)nn2)nc1

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

Other Identifiers

Properties
HBA: 11 RingCount: 3
HBD: 4 FractionCSP3: 0.56
AlogP: -1.39 Num_rotatable_bonds: 7
MolWt: 407.43 Num_heavy_atoms: 29
TPSA: 151.85 NumAromaticRings: 2

Unique Aglycone
AD36549
Formula: C10H12ON4

Smiles:
Cc1ccc(-c2cn(CCO)nn2)nc1
HBA: 5 RingCount: 2
HBD: 1 FractionCSP3: 0.3
AlogP: 0.64 Num_rotatable_bonds: 3
MolWt: 204.23 Num_heavy_atoms: 15
TPSA: 63.83 NumAromaticRings: 2

Sugarmoiety
SD00014

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