Glycoside
...
GD039157

Name:
phosphomethylphosphonic acid guanylate ester

Formula:
C11H18O13N5P3

Smiles:
Nc1nc2c(ncn2[C@H]2O[C@H](CO[P@](=O)(O)O[P@@](=O)(O)CP(=O)(O)O)[C@H](O)[C@@H]2O)c(=O)[nH]1

Aglycone:
COP(=O)(O)OP(=O)(O)CP(=O)(O)O.Nc1nc2c(c(=O)[nH]1)N=C[N]2

Sugarmoiety:
OC1OC(O)C(O)C1O

Other Identifiers

Properties
HBA: 18 RingCount: 3
HBD: 9 FractionCSP3: 0.55
AlogP: -2.22 Num_rotatable_bonds: 8
MolWt: 521.21 Num_heavy_atoms: 32
TPSA: 289.87 NumAromaticRings: 2

Unique Aglycone
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
AD06058
Formula: C2H9O9P3

Smiles:
COP(=O)(O)OP(=O)(O)CP(=O)(O)O
HBA: 9 RingCount: 0
HBD: 4 FractionCSP3: 1.0
AlogP: 0.07 Num_rotatable_bonds: 5
MolWt: 270.01 Num_heavy_atoms: 14
TPSA: 150.59 NumAromaticRings: 0

Sugarmoiety
SD00018

OC1OC(O)C(O)C1O