Glycoside
...
GD044666

Name:
None

Formula:
C13H15O4N4

Smiles:
C#C[C@@]1(O)[C@H](O)[C@@H](CO)O[C@H]1n1ccc2c(N)[nH+]cnc21

Aglycone:
Nc1[nH+]cnc2c1C=C[N]2

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

Other Identifiers

Properties
HBA: 8 RingCount: 3
HBD: 6 FractionCSP3: 0.38
AlogP: -1.95 Num_rotatable_bonds: 2
MolWt: 291.29 Num_heavy_atoms: 21
TPSA: 127.9 NumAromaticRings: 2

Unique Aglycone
AD24858
Formula: C6H6N4

Smiles:
Nc1[nH+]cnc2c1C=C[N]2
HBA: 4 RingCount: 2
HBD: 3 FractionCSP3: 0.0
AlogP: -0.3 Num_rotatable_bonds: 0
MolWt: 134.14 Num_heavy_atoms: 10
TPSA: 67.15 NumAromaticRings: 1

Sugarmoiety
SD00138

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