Glycoside
...
GD098246

Name:
None

Formula:
C22H27O7N5

Smiles:
CC(C)(COCc1ccccc1)c1cn([C@]2(CO)O[C@@H](n3ccc(=O)[nH]c3=O)[C@@H](O)[C@@H]2O)nn1

Aglycone:
CC(C)(COCc1ccccc1)C1=C[N]N=N1.O=c1cc[nH]c(=O)[nH]1

Sugarmoiety:
OCC1(O)OC(O)C(O)C1O

Other Identifiers

Properties
HBA: 12 RingCount: 4
HBD: 4 FractionCSP3: 0.45
AlogP: -0.78 Num_rotatable_bonds: 8
MolWt: 473.49 Num_heavy_atoms: 34
TPSA: 164.72 NumAromaticRings: 3

Unique Aglycone
AD00106
Formula: C4H4O2N2

Smiles:
O=c1cc[nH]c(=O)[nH]1
HBA: 4 RingCount: 1
HBD: 2 FractionCSP3: 0.0
AlogP: -0.94 Num_rotatable_bonds: 0
MolWt: 112.09 Num_heavy_atoms: 8
TPSA: 65.72 NumAromaticRings: 1
AD41802
Formula: C13H16ON3

Smiles:
CC(C)(COCc1ccccc1)C1=C[N]N=N1
HBA: 4 RingCount: 2
HBD: 0 FractionCSP3: 0.38
AlogP: 3.06 Num_rotatable_bonds: 5
MolWt: 230.29 Num_heavy_atoms: 17
TPSA: 48.05 NumAromaticRings: 1

Sugarmoiety
SD01068

OCC1(O)OC(O)C(O)C1O