Glycoside
...
GD023472

Name:
None

Formula:
C16H19O8N5

Smiles:
CC(=O)OC[C@@H]1O[C@H](N2C=NC3C(=O)N=C(N)N=C32)[C@H](OC(C)=O)[C@H]1OC(C)=O

Aglycone:
COC(C)=O.NC1=NC(=O)C2N=CNC2=N1

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

Other Identifiers

Properties
HBA: 13 RingCount: 3
HBD: 2 FractionCSP3: 0.56
AlogP: -1.9 Num_rotatable_bonds: 5
MolWt: 409.36 Num_heavy_atoms: 29
TPSA: 171.54 NumAromaticRings: 0

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
AD15779
Formula: C5H5ON5

Smiles:
NC1=NC(=O)C2N=CNC2=N1
HBA: 6 RingCount: 2
HBD: 3 FractionCSP3: 0.2
AlogP: -1.76 Num_rotatable_bonds: 0
MolWt: 151.13 Num_heavy_atoms: 11
TPSA: 92.2 NumAromaticRings: 0

Sugarmoiety
SD00105

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