Glycoside
...
GD100365

Name:
None

Formula:
C22H29O7N6

Smiles:
CC(=O)OC[C@H]1O[C@@H](n2cnc3c(/N=C4\CCC[N@@H+](C)C4)ncnc32)[C@H](OC(C)=O)[C@@H]1OC(C)=O

Aglycone:
COC(C)=O.C[NH+]1CCCC(=Nc2ncnc3c2N=C[N]3)C1

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

Other Identifiers

Properties
HBA: 13 RingCount: 4
HBD: 1 FractionCSP3: 0.59
AlogP: -0.47 Num_rotatable_bonds: 6
MolWt: 489.51 Num_heavy_atoms: 35
TPSA: 148.53 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
AD35541
Formula: C11H14N6

Smiles:
C[NH+]1CCCC(=Nc2ncnc3c2N=C[N]3)C1
HBA: 6 RingCount: 3
HBD: 1 FractionCSP3: 0.45
AlogP: -0.23 Num_rotatable_bonds: 1
MolWt: 230.28 Num_heavy_atoms: 17
TPSA: 69.04 NumAromaticRings: 1

Sugarmoiety
SD00105

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