Glycoside
...
GD017996

Name:
None

Formula:
C11H12O5N3F

Smiles:
C#C[C@@]1(O)[C@H](CO)O[C@H](n2cc(F)c(N)nc2=O)[C@H]1O

Aglycone:
Nc1nc(=O)[nH]cc1F

Sugarmoiety:
C#CC1(O)C(CO)OC(O)C1O

Other Identifiers

Properties
HBA: 8 RingCount: 2
HBD: 5 FractionCSP3: 0.45
AlogP: -2.42 Num_rotatable_bonds: 2
MolWt: 285.23 Num_heavy_atoms: 20
TPSA: 130.83 NumAromaticRings: 1

Unique Aglycone
AD03270
Formula: C4H4ON3F

Smiles:
Nc1nc(=O)[nH]cc1F
HBA: 4 RingCount: 1
HBD: 3 FractionCSP3: 0.0
AlogP: -0.51 Num_rotatable_bonds: 0
MolWt: 129.09 Num_heavy_atoms: 9
TPSA: 71.77 NumAromaticRings: 1

Sugarmoiety
SD00341

C#CC1(O)C(CO)OC(O)C1O