Glycoside
...
GD100996

Name:
None

Formula:
C21H27O5N6F

Smiles:
O=C(Nc1nc(F)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)N[C@]12C[C@H]3C[C@H](C[C@H](C3)C1)C2

Aglycone:
O=C(Nc1nc(F)nc2c1N=C[N]2)NC12CC3CC(CC(C3)C1)C2

Sugarmoiety:
OCC1OC(O)C(O)C1O

Other Identifiers

Properties
HBA: 11 RingCount: 7
HBD: 5 FractionCSP3: 0.71
AlogP: 0.67 Num_rotatable_bonds: 4
MolWt: 462.48 Num_heavy_atoms: 33
TPSA: 154.65 NumAromaticRings: 2

Unique Aglycone
AD42689
Formula: C16H18ON6F

Smiles:
O=C(Nc1nc(F)nc2c1N=C[N]2)NC12CC3CC(CC(C3)C1)C2
HBA: 7 RingCount: 6
HBD: 2 FractionCSP3: 0.62
AlogP: 2.62 Num_rotatable_bonds: 2
MolWt: 329.36 Num_heavy_atoms: 24
TPSA: 93.37 NumAromaticRings: 1

Sugarmoiety
SD00015

OCC1OC(O)C(O)C1O