Glycoside
...
GD096308

Name:
None

Formula:
C20H27O7N6

Smiles:
C[NH2+][C@H]1CCN1c1ncnc2c1ncn2[C@@H]1O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O

Aglycone:
COC(C)=O.C[NH2+]C1CCN1c1ncnc2c1N=C[N]2

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

Other Identifiers

Properties
HBA: 13 RingCount: 4
HBD: 2 FractionCSP3: 0.6
AlogP: -1.12 Num_rotatable_bonds: 7
MolWt: 463.47 Num_heavy_atoms: 33
TPSA: 151.58 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
AD40957
Formula: C9H12N6

Smiles:
C[NH2+]C1CCN1c1ncnc2c1N=C[N]2
HBA: 6 RingCount: 3
HBD: 2 FractionCSP3: 0.44
AlogP: -0.88 Num_rotatable_bonds: 2
MolWt: 204.24 Num_heavy_atoms: 15
TPSA: 72.09 NumAromaticRings: 1

Sugarmoiety
SD00105

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