Glycoside
...
GD096203

Name:
None

Formula:
C22H29O5N7

Smiles:
C[C@H](Cc1ccccc1)N(C)Cc1cn([C@]2(CO)O[C@@H](n3ccc(N)nc3=O)[C@@H](O)[C@@H]2O)nn1

Aglycone:
CC(Cc1ccccc1)N(C)CC1=C[N]N=N1.Nc1cc[nH]c(=O)n1

Sugarmoiety:
OCC1(O)OC(O)C(O)C1O

Other Identifiers

Properties
HBA: 12 RingCount: 4
HBD: 5 FractionCSP3: 0.45
AlogP: -0.92 Num_rotatable_bonds: 8
MolWt: 471.52 Num_heavy_atoms: 34
TPSA: 164.78 NumAromaticRings: 3

Unique Aglycone
AD00115
Formula: C4H5ON3

Smiles:
Nc1cc[nH]c(=O)n1
HBA: 4 RingCount: 1
HBD: 3 FractionCSP3: 0.0
AlogP: -0.65 Num_rotatable_bonds: 0
MolWt: 111.1 Num_heavy_atoms: 8
TPSA: 71.77 NumAromaticRings: 1
AD40921
Formula: C13H17N4

Smiles:
CC(Cc1ccccc1)N(C)CC1=C[N]N=N1
HBA: 4 RingCount: 2
HBD: 0 FractionCSP3: 0.38
AlogP: 2.38 Num_rotatable_bonds: 5
MolWt: 229.31 Num_heavy_atoms: 17
TPSA: 42.06 NumAromaticRings: 1

Sugarmoiety
SD01068

OCC1(O)OC(O)C(O)C1O