Glycoside
...
GD095592

Name:
None

Formula:
C15H21O15N3

Smiles:
O=C(CC[N+](=O)[O-])OC[C@H]1O[C@H](O)[C@H](OC(=O)CC[N+](=O)[O-])[C@@H](OC(=O)CC[N+](=O)[O-])[C@@H]1O

Aglycone:
COC(=O)CC[N+](=O)[O-].O=C(O)CC[N+](=O)[O-].O=C(O)CC[N+](=O)[O-]

Sugarmoiety:
OC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 18 RingCount: 1
HBD: 2 FractionCSP3: 0.8
AlogP: -2.57 Num_rotatable_bonds: 13
MolWt: 483.34 Num_heavy_atoms: 33
TPSA: 258.01 NumAromaticRings: 0

Unique Aglycone
AD09161
Formula: C4H7O4N

Smiles:
COC(=O)CC[N+](=O)[O-]
HBA: 5 RingCount: 0
HBD: 0 FractionCSP3: 0.75
AlogP: -0.17 Num_rotatable_bonds: 3
MolWt: 133.1 Num_heavy_atoms: 9
TPSA: 69.44 NumAromaticRings: 0
AD09162
Formula: C3H5O4N

Smiles:
O=C(O)CC[N+](=O)[O-]
HBA: 5 RingCount: 0
HBD: 1 FractionCSP3: 0.67
AlogP: -0.26 Num_rotatable_bonds: 3
MolWt: 119.08 Num_heavy_atoms: 8
TPSA: 80.44 NumAromaticRings: 0

Sugarmoiety
SD00017

OC1OC(O)C(O)C(O)C1O