Glycoside
...
GD029135

Name:
None

Formula:
C15H13O4N2Cl

Smiles:
C#C[C@@]1(O)[C@H](CO)O[C@H](n2ccc3c(Cl)ccnc32)[C@H]1O

Aglycone:
Clc1ccnc2c1C=C[N]2

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

Other Identifiers

Properties
HBA: 6 RingCount: 3
HBD: 3 FractionCSP3: 0.36
AlogP: 0.3 Num_rotatable_bonds: 2
MolWt: 308.72 Num_heavy_atoms: 21
TPSA: 87.74 NumAromaticRings: 2

Unique Aglycone
AD18990
Formula: C8H4N2Cl

Smiles:
Clc1ccnc2c1C=C[N]2
HBA: 2 RingCount: 2
HBD: 0 FractionCSP3: 0.0
AlogP: 1.96 Num_rotatable_bonds: 0
MolWt: 151.58 Num_heavy_atoms: 10
TPSA: 26.99 NumAromaticRings: 1

Sugarmoiety
SD00341

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