Glycoside
...
GD000475

Name:
None

Formula:
C15H15O5N8Cl

Smiles:
CC(=O)O[C@@H]1[C@@H](n2cnc3c(N)nc(Cl)nc32)O[C@@H](CN=[N+]=[N-])[C@H]1OC(C)=O

Aglycone:
Nc1nc(Cl)nc2c1N=C[N]2

Sugarmoiety:
CC(=O)OC1C(O)OC(CN=[N+]=[N-])C1OC(C)=O

Other Identifiers

Properties
HBA: 13 RingCount: 3
HBD: 2 FractionCSP3: 0.5
AlogP: 1.13 Num_rotatable_bonds: 5
MolWt: 410.78 Num_heavy_atoms: 28
TPSA: 180.21 NumAromaticRings: 2

Unique Aglycone
AD00532
Formula: C6H3N5Cl

Smiles:
Nc1nc(Cl)nc2c1N=C[N]2
HBA: 5 RingCount: 2
HBD: 2 FractionCSP3: 0.0
AlogP: 0.62 Num_rotatable_bonds: 0
MolWt: 168.57 Num_heavy_atoms: 11
TPSA: 78.26 NumAromaticRings: 1

Sugarmoiety
SD00178

CC(=O)OC1C(O)OC(CN=[N+]=[N-])C1OC(C)=O