Glycoside
...
GD095423

Name:
None

Formula:
C16H15O6N6Br

Smiles:
O=c1ccn([C@@H]2O[C@@](CO)(n3cc(-c4ccc(Br)nc4)nn3)[C@@H](O)[C@@H]2O)c(=O)[nH]1

Aglycone:
Brc1ccc(C2=C[N]N=N2)cn1.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: 0.31
AlogP: -1.45 Num_rotatable_bonds: 4
MolWt: 467.24 Num_heavy_atoms: 29
TPSA: 168.38 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
AD40736
Formula: C7H4N4Br

Smiles:
Brc1ccc(C2=C[N]N=N2)cn1
HBA: 4 RingCount: 2
HBD: 0 FractionCSP3: 0.0
AlogP: 2.13 Num_rotatable_bonds: 1
MolWt: 224.04 Num_heavy_atoms: 12
TPSA: 51.71 NumAromaticRings: 1

Sugarmoiety
SD01068

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