Glycoside
...
GD017873

Name:
None

Formula:
C16H16O4N5Br

Smiles:
Nc1nc(OCc2ccc(Br)cc2)c2ncn(C3CC(O)C(O)O3)c2n1

Aglycone:
Nc1nc2c(c(OCc3ccc(Br)cc3)n1)N=C[N]2

Sugarmoiety:
OC1CC(O)C(O)O1

Other Identifiers

Properties
HBA: 9 RingCount: 4
HBD: 4 FractionCSP3: 0.31
AlogP: 1.35 Num_rotatable_bonds: 4
MolWt: 422.24 Num_heavy_atoms: 26
TPSA: 128.54 NumAromaticRings: 3

Unique Aglycone
AD11091
Formula: C12H9ON5Br

Smiles:
Nc1nc2c(c(OCc3ccc(Br)cc3)n1)N=C[N]2
HBA: 6 RingCount: 3
HBD: 2 FractionCSP3: 0.08
AlogP: 2.31 Num_rotatable_bonds: 3
MolWt: 319.14 Num_heavy_atoms: 19
TPSA: 87.49 NumAromaticRings: 2

Sugarmoiety
SD00062

OC1CC(O)C(O)O1