Glycoside
...
GD105739

Name:
None

Formula:
C20H27O11N10P

Smiles:
Nc1nc2c(ncn2[C@@H]2O[C@H](CO)[C@H](O)[C@@H]2O[PH](O)(O)OC[C@@H]2O[C@H](n3cnc4c(N)ncnc43)[C@@H](O)[C@@H]2O)c(=O)[nH]1

Aglycone:
CO[PH](O)(O)O.Nc1nc2c(c(=O)[nH]1)N=C[N]2.Nc1ncnc2c1N=C[N]2

Sugarmoiety:
OCC1OC(O)C(O)C1O.OCC1OC(O)OC1O

Other Identifiers

Properties
HBA: 21 RingCount: 6
HBD: 11 FractionCSP3: 0.5
AlogP: -4.21 Num_rotatable_bonds: 8
MolWt: 614.47 Num_heavy_atoms: 42
TPSA: 317.51 NumAromaticRings: 4

Unique Aglycone
AD00058
Formula: C5H4N5

Smiles:
Nc1ncnc2c1N=C[N]2
HBA: 5 RingCount: 2
HBD: 2 FractionCSP3: 0.0
AlogP: -0.03 Num_rotatable_bonds: 0
MolWt: 134.12 Num_heavy_atoms: 10
TPSA: 78.26 NumAromaticRings: 1
AD00207
Formula: C5H4ON5

Smiles:
Nc1nc2c(c(=O)[nH]1)N=C[N]2
HBA: 6 RingCount: 2
HBD: 3 FractionCSP3: 0.0
AlogP: -0.74 Num_rotatable_bonds: 0
MolWt: 150.12 Num_heavy_atoms: 11
TPSA: 98.23 NumAromaticRings: 1
AD01852
Formula: CH7O4P

Smiles:
CO[PH](O)(O)O
HBA: 4 RingCount: 0
HBD: 3 FractionCSP3: 1.0
AlogP: -0.98 Num_rotatable_bonds: 1
MolWt: 114.04 Num_heavy_atoms: 6
TPSA: 69.92 NumAromaticRings: 0

Sugarmoiety
SD03387

OCC1OC(O)C(O)C1O.OCC1OC(O)OC1O