Glycoside
...
GD012054

Name:
None

Formula:
C24H30O10N4

Smiles:
CC(=O)OC[C@@H]1O[C@H](OCC(=O)NCc2cn(Cc3ccccc3)nn2)[C@H](O)[C@H](OC(C)=O)[C@H]1OC(C)=O

Aglycone:
COC(C)=O.O=C(CO)NCc1cn(Cc2ccccc2)nn1

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

Other Identifiers

Properties
HBA: 14 RingCount: 3
HBD: 2 FractionCSP3: 0.5
AlogP: -0.53 Num_rotatable_bonds: 11
MolWt: 534.52 Num_heavy_atoms: 38
TPSA: 177.4 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
AD05919
Formula: C12H14O2N4

Smiles:
O=C(CO)NCc1cn(Cc2ccccc2)nn1
HBA: 6 RingCount: 2
HBD: 2 FractionCSP3: 0.25
AlogP: -0.07 Num_rotatable_bonds: 5
MolWt: 246.27 Num_heavy_atoms: 18
TPSA: 80.04 NumAromaticRings: 2

Sugarmoiety
SD00013

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