Glycoside
...
GD029621

Name:
None

Formula:
C34H30O9N6

Smiles:
COC(=O)c1nc(-c2cn(Cc3ccc4ccc5cccc6ccc3c4c56)nn2)n([C@@H]2O[C@H](COC(C)=O)[C@H](OC(C)=O)[C@H]2OC(C)=O)n1

Aglycone:
COC(=O)C1=N[N]C(c2cn(Cc3ccc4ccc5cccc6ccc3c4c56)nn2)=N1.COC(C)=O

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

Other Identifiers

Properties
HBA: 15 RingCount: 7
HBD: 0 FractionCSP3: 0.29
AlogP: 3.59 Num_rotatable_bonds: 9
MolWt: 666.65 Num_heavy_atoms: 49
TPSA: 175.85 NumAromaticRings: 6

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
AD19252
Formula: C23H15O2N6

Smiles:
COC(=O)C1=N[N]C(c2cn(Cc3ccc4ccc5cccc6ccc3c4c56)nn2)=N1
HBA: 8 RingCount: 6
HBD: 0 FractionCSP3: 0.09
AlogP: 3.07 Num_rotatable_bonds: 4
MolWt: 407.41 Num_heavy_atoms: 31
TPSA: 95.83 NumAromaticRings: 5

Sugarmoiety
SD00105

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