Glycoside
...
GD098237

Name:
None

Formula:
C21H26O6N6

Smiles:
CCN(CC)c1ccc(-c2cn([C@]3(CO)O[C@@H](n4ccc(=O)[nH]c4=O)[C@@H](O)[C@@H]3O)nn2)cc1

Aglycone:
CCN(CC)c1ccc(C2=C[N]N=N2)cc1.O=c1cc[nH]c(=O)[nH]1

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

Other Identifiers

Properties
HBA: 12 RingCount: 4
HBD: 4 FractionCSP3: 0.43
AlogP: -0.76 Num_rotatable_bonds: 7
MolWt: 458.48 Num_heavy_atoms: 33
TPSA: 158.73 NumAromaticRings: 3

Unique Aglycone
AD00106
Formula: C4H4O2N2

Smiles:
O=c1cc[nH]c(=O)[nH]1
HBA: 4 RingCount: 1
HBD: 2 FractionCSP3: 0.0
AlogP: -0.94 Num_rotatable_bonds: 0
MolWt: 112.09 Num_heavy_atoms: 8
TPSA: 65.72 NumAromaticRings: 1
AD41798
Formula: C12H15N4

Smiles:
CCN(CC)c1ccc(C2=C[N]N=N2)cc1
HBA: 4 RingCount: 2
HBD: 0 FractionCSP3: 0.33
AlogP: 2.82 Num_rotatable_bonds: 4
MolWt: 215.28 Num_heavy_atoms: 16
TPSA: 42.06 NumAromaticRings: 1

Sugarmoiety
SD01068

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