Glycoside
...
GD062790

Name:
None

Formula:
C14H18O8N4

Smiles:
CC(=O)OC[C@H]1O[C@@H](n2cnc(N)nc2=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O

Aglycone:
COC(C)=O.Nc1nc[nH]c(=O)n1

Sugarmoiety:
CC(=O)OC1C(O)OC(O)C1OC(C)=O

Other Identifiers

Properties
HBA: 12 RingCount: 2
HBD: 2 FractionCSP3: 0.57
AlogP: -1.46 Num_rotatable_bonds: 5
MolWt: 370.32 Num_heavy_atoms: 26
TPSA: 161.93 NumAromaticRings: 1

Unique Aglycone
AD00017
Formula: C3H6O2

Smiles:
COC(C)=O
HBA: 2 RingCount: 0
HBD: 0 FractionCSP3: 0.67
AlogP: 0.18 Num_rotatable_bonds: 0
MolWt: 74.08 Num_heavy_atoms: 5
TPSA: 26.3 NumAromaticRings: 0
AD01340
Formula: C3H4ON4

Smiles:
Nc1nc[nH]c(=O)n1
HBA: 5 RingCount: 1
HBD: 3 FractionCSP3: 0.0
AlogP: -1.25 Num_rotatable_bonds: 0
MolWt: 112.09 Num_heavy_atoms: 8
TPSA: 84.66 NumAromaticRings: 1

Sugarmoiety
SD00105

CC(=O)OC1C(O)OC(O)C1OC(C)=O