Glycoside
...
GD007167

Name:
None

Formula:
C14H27O7N7

Smiles:
[N-]=[N+]=NCC(=O)NC[C@@H]1O[C@H](O[C@@H]2[C@H](N)C[C@H](N)[C@H](O)[C@H]2O)[C@H](N)[C@H](O)[C@H]1O

Aglycone:
CNC(=O)CN=[N+]=[N-].NC1CC(N)C(O)C(O)C1O

Sugarmoiety:
NC1C(O)OC(O)C(O)C1O

Other Identifiers

Properties
HBA: 14 RingCount: 2
HBD: 11 FractionCSP3: 0.93
AlogP: -4.65 Num_rotatable_bonds: 6
MolWt: 405.41 Num_heavy_atoms: 28
TPSA: 255.3 NumAromaticRings: 0

Unique Aglycone
AD00009
Formula: C6H14O3N2

Smiles:
NC1CC(N)C(O)C(O)C1O
HBA: 5 RingCount: 1
HBD: 7 FractionCSP3: 1.0
AlogP: -2.87 Num_rotatable_bonds: 0
MolWt: 162.19 Num_heavy_atoms: 11
TPSA: 112.73 NumAromaticRings: 0
AD05858
Formula: C3H6ON4

Smiles:
CNC(=O)CN=[N+]=[N-]
HBA: 5 RingCount: 0
HBD: 1 FractionCSP3: 0.67
AlogP: 0.04 Num_rotatable_bonds: 2
MolWt: 114.11 Num_heavy_atoms: 8
TPSA: 77.86 NumAromaticRings: 0

Sugarmoiety
SD00266

NC1C(O)OC(O)C(O)C1O