Glycoside
...
GD021819

Name:
None

Formula:
C12H10O3N6ClI

Smiles:
[N-]=[N+]=NC[C@@H]1O[C@H](n2cc(I)c3c(Cl)ncnc32)[C@H](O)[C@H]1O

Aglycone:
Clc1ncnc2c1C(I)=C[N]2

Sugarmoiety:
[N-]=[N+]=NCC1OC(O)C(O)C1O

Other Identifiers

Properties
HBA: 9 RingCount: 3
HBD: 2 FractionCSP3: 0.45
AlogP: 1.62 Num_rotatable_bonds: 3
MolWt: 436.6 Num_heavy_atoms: 22
TPSA: 129.16 NumAromaticRings: 2

Unique Aglycone
AD06604
Formula: C7H2N3ClI

Smiles:
Clc1ncnc2c1C(I)=C[N]2
HBA: 3 RingCount: 2
HBD: 0 FractionCSP3: 0.0
AlogP: 2.11 Num_rotatable_bonds: 0
MolWt: 278.46 Num_heavy_atoms: 11
TPSA: 39.88 NumAromaticRings: 1

Sugarmoiety
SD00382

[N-]=[N+]=NCC1OC(O)C(O)C1O