Glycoside
...
GD019241

Name:
None

Formula:
C22H26O4N6

Smiles:
C[C@H](NC(=O)[C@H](O)[C@H](O)C(=O)N1CCC[C@H]1c1cc[nH]n1)c1ccc(-n2cccn2)cc1

Aglycone:
CC(N)c1ccc(-n2cccn2)cc1.c1cc(C2CCCN2)n[nH]1

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

Other Identifiers

Properties
HBA: 10 RingCount: 4
HBD: 4 FractionCSP3: 0.36
AlogP: 0.86 Num_rotatable_bonds: 7
MolWt: 438.49 Num_heavy_atoms: 32
TPSA: 136.37 NumAromaticRings: 3

Unique Aglycone
AD01153
Formula: C11H13N3

Smiles:
CC(N)c1ccc(-n2cccn2)cc1
HBA: 3 RingCount: 2
HBD: 2 FractionCSP3: 0.18
AlogP: 1.89 Num_rotatable_bonds: 2
MolWt: 187.25 Num_heavy_atoms: 14
TPSA: 43.84 NumAromaticRings: 2
AD13456
Formula: C7H11N3

Smiles:
c1cc(C2CCCN2)n[nH]1
HBA: 3 RingCount: 2
HBD: 2 FractionCSP3: 0.57
AlogP: 0.83 Num_rotatable_bonds: 1
MolWt: 137.19 Num_heavy_atoms: 10
TPSA: 40.71 NumAromaticRings: 1

Sugarmoiety
SD00169

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