Glycoside
...
GD101500

Name:
None

Formula:
C20H23O9N4F

Smiles:
CC(=O)OC[C@H]1O[C@@H](OC(C)=O)[C@H](Nc2ncnc3[nH]cc(F)c23)[C@@H](OC(C)=O)[C@@H]1OC(C)=O

Aglycone:
COC(C)=O.Nc1ncnc2[nH]cc(F)c12

Sugarmoiety:
CC(=O)OC1OC(O)C(OC(C)=O)C(OC(C)=O)C1O

Other Identifiers

Properties
HBA: 13 RingCount: 3
HBD: 2 FractionCSP3: 0.5
AlogP: 0.59 Num_rotatable_bonds: 7
MolWt: 482.42 Num_heavy_atoms: 34
TPSA: 168.03 NumAromaticRings: 2

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
AD42963
Formula: C6H5N4F

Smiles:
Nc1ncnc2[nH]cc(F)c12
HBA: 4 RingCount: 2
HBD: 3 FractionCSP3: 0.0
AlogP: 0.68 Num_rotatable_bonds: 0
MolWt: 152.13 Num_heavy_atoms: 11
TPSA: 67.59 NumAromaticRings: 2

Sugarmoiety
SD00889

CC(=O)OC1OC(O)C(OC(C)=O)C(OC(C)=O)C1O